4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine

C82H97N31O4S — CID 163856269

IUPAC4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine
SMILESCC(C)OCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.CCOCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.COCCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.Nc1nc(NCC2CCCO2)c2c(ccn2Cc2ccccn2)n1.Nc1nc(NCc2nccs2)c2c(ccn2Cc2ccccn2)n1
InChIInChI=1S/C17H20N6O.C17H22N6O.C16H15N7S.2C16H20N6O/c18-17-21-14-6-8-23(11-12-4-1-2-7-19-12)15(14)16(22-17)20-10-13-5-3-9-24-13;1-12(2)24-10-8-20-16-15-14(21-17(18)22-16)6-9-23(15)11-13-5-3-4-7-19-13;17-16-21-12-4-7-23(10-11-3-1-2-5-18-11)14(12)15(22-16)20-9-13-19-6-8-24-13;1-23-10-4-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-2-3-7-18-12;1-2-23-10-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-3-4-7-18-12/h1-2,4,6-8,13H,3,5,9-11H2,(H3,18,20,21,22);3-7,9,12H,8,10-11H2,1-2H3,(H3,18,20,21,22);1-8H,9-10H2,(H3,17,20,21,22);2-3,5-7,9H,4,8,10-11H2,1H3,(H3,17,19,20,21);3-7,9H,2,8,10-11H2,1H3,(H3,17,19,20,21)
InChIKeyOYOMSWVIWXTYTM-UHFFFAOYSA-N
MW1612.96 g/mol
LogP10.68
Rot. Bonds31

About 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine

4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine (PubChem CID 163856269) has the molecular formula C82H97N31O4S and a molecular weight of 1612.96 g/mol. Its IUPAC name is 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine
PubChem CID163856269
Molecular FormulaC82H97N31O4S
Molecular Weight1612.96 g/mol
Exact Mass1611.81
IUPAC Name4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine
SMILESCC(C)OCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.CCOCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.COCCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.Nc1nc(NCC2CCCO2)c2c(ccn2Cc2ccccn2)n1.Nc1nc(NCc2nccs2)c2c(ccn2Cc2ccccn2)n1
InChIInChI=1S/C17H20N6O.C17H22N6O.C16H15N7S.2C16H20N6O/c18-17-21-14-6-8-23(11-12-4-1-2-7-19-12)15(14)16(22-17)20-10-13-5-3-9-24-13;1-12(2)24-10-8-20-16-15-14(21-17(18)22-16)6-9-23(15)11-13-5-3-4-7-19-13;17-16-21-12-4-7-23(10-11-3-1-2-5-18-11)14(12)15(22-16)20-9-13-19-6-8-24-13;1-23-10-4-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-2-3-7-18-12;1-2-23-10-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-3-4-7-18-12/h1-2,4,6-8,13H,3,5,9-11H2,(H3,18,20,21,22);3-7,9,12H,8,10-11H2,1-2H3,(H3,18,20,21,22);1-8H,9-10H2,(H3,17,20,21,22);2-3,5-7,9H,4,8,10-11H2,1H3,(H3,17,19,20,21);3-7,9H,2,8,10-11H2,1H3,(H3,17,19,20,21)
InChIKeyOYOMSWVIWXTYTM-UHFFFAOYSA-N
XLogP10.68
TPSA458.06 Ų
H-Bond Donors10
H-Bond Acceptors36
Rotatable Bonds31
Heavy Atoms118
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001612.96
LogP ≤ 510.68
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]-N-[5-(2-oxa-5-azabicyclo[2.2.1]heptan-5-ylmethyl)pyrazin-2-yl]-1,3-thiazol-2-amine
CID 59295350
4-[9-methyl-8-[(4-morpholin-4-ylpiperidin-1-yl)methyl]-2-(1H-pyrrolo[2,3-c]pyridin-4-yl)purin-6-yl]morpholine;4-[6-(morpholin-4-ylmethyl)-2-(1H-pyrrolo[3,2-c]pyridin-4-yl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 87577839
4-([1,3]Thiazolo[4,5-b]pyridin-2-yl)morpholine;4-([1,3]thiazolo[4,5-c]pyridin-2-yl)morpholine;4-([1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine
CID 155684004
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;1-(2-fluoroethyl)-1-methyl-4-propan-2-ylpiperazin-1-ium;3-methylbutan-2-imine;2-methylidene-4-propan-2-ylimidazolidine;4-methyl-2-propan-2-ylmorpholine;4-methyl-N'-propan-2-ylpiperazine-1-carboximidamide;2-(2-methylpropyl)pyrimidine;N-propan-2-yl-1H-benzimidazol-2-amine;N'-propan-2-ylethanimidamide;bis(N-propan-2-yl-1H-imidazol-2-amine);1-propan-2-ylpiperazine;1-(4-propan-2-ylpiperazin-1-yl)ethanimine;N-propan-2-yl-1,3-thiazol-2-amine;propan-2-ylurea
CID 157228969
1,3-Dimethylpyrrolidine;ethane;2-ethylimidazo[1,2-a]pyridine;2-ethyl-1-methylimidazole;1-ethyl-3-methylpiperidine;bis(1-ethyl-3-methylpyrrolidine);2-ethyloxolane;2-ethylpyrazine;3-ethylpyridine;4-ethyl-1,3-thiazole;methylcyclopentane;3-methyl-1-propan-2-ylpyrrolidine;3-methylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 157533352
(2R,3R,4S,5R)-2-(7-amino-2-butylsulfanylimidazo[4,5-b]pyridin-3-yl)-5-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]oxolane-3,4-diol;(2R,3R,4S,5R)-2-(7-amino-5-methylimidazo[4,5-b]pyridin-3-yl)-5-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]oxolane-3,4-diol;(2R,3R,4S,5R)-2-(7-amino-2-pentylsulfanylimidazo[4,5-b]pyridin-3-yl)-5-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]oxolane-3,4-diol;(2R,3R,4S,5R)-2-(2,7-diaminoimidazo[4,5-b]pyridin-3-yl)-5-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]oxolane-3,4-diol;(2R,3S,4R,5R)-2-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]-5-[6-(ethylamino)purin-9-yl]oxolane-3,4-diol;(2R,3S,4R,5R)-2-[2-[dimethyl(methylidene)-lambda5-phosphanyl]ethyl]-5-[7-(methylamino)imidazo[4,5-b]pyridin-3-yl]oxolane-3,4-diol
CID 157601518
5-benzyl-2-methyl-N-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-benzyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(2-morpholin-4-ylethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(2-pyrrol-1-ylethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(thiophen-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(thiophen-3-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
CID 158241341
5-Bromo-2-methyl-1,3-thiazole;4-[4-(2,4-dimethylimidazol-1-yl)-7-[[4-(2-methyl-1,3-thiazol-5-yl)piperazin-1-yl]methyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;4-[4-(2,4-dimethylimidazol-1-yl)-7-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]morpholine
CID 158623188
1,3-Dimethylpyrrolidine;ethane;2-ethylimidazo[1,2-a]pyridine;2-ethyl-1-methylimidazole;1-ethyl-3-methylpiperidine;bis(1-ethyl-3-methylpyrrolidine);2-ethyloxolane;2-ethylpyrazine;3-ethylpyridine;4-ethyl-1,3-thiazole;methylcyclopentane;3-methyl-1-propan-2-ylpyrrolidine;3-methylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpyrrolidine
CID 158759597
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;2-methylidene-4-propan-2-ylimidazolidine;2-methylpropanimidamide;4-methyl-2-propan-2-ylmorpholine;4-methyl-N'-propan-2-ylpiperazine-1-carboximidamide;1-methyl-4-propan-2-yl-1-propylpiperazin-1-ium;2-(2-methylpropyl)pyrimidine;N-propan-2-ylacetamide;N-propan-2-yl-1H-benzimidazol-2-amine;N'-propan-2-ylethanimidamide;bis(N-propan-2-yl-1H-imidazol-2-amine);4-propan-2-ylpiperazine-1-carboximidamide;1-propan-2-ylpiperidine;N-propan-2-yl-1,3-thiazol-2-amine
CID 158816838
N,N-dimethyl-2-(4-propan-2-ylpiperazin-1-yl)ethanamine;6-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-3-amine;N-(2-morpholin-4-ylethyl)propan-2-amine;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine;N-(oxolan-2-ylmethyl)propan-2-amine;N-(2-phenylethyl)propan-2-amine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-(2-pyridin-2-ylethyl)piperazine;N-propan-2-ylpyrrolidin-3-amine;1-propan-2-ylpyrrolidine;1-propan-2-yl-4-(2-thiophen-2-ylethyl)piperazine;N-(2-pyrrolidin-1-ylethyl)propan-2-amine;N-(pyrrolidin-2-ylmethyl)propan-2-amine;N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 159078006
1-tert-butyl-4-(2-imidazol-1-ylethyl)piperazine;2-(4-tert-butylpiperazin-1-yl)acetamide;2-(4-tert-butylpiperazin-1-yl)-N,N-dimethylethanamine;4-[2-(4-tert-butylpiperazin-1-yl)ethyl]morpholine;2-(4-tert-butylpiperazin-1-yl)pyrazine;2-(4-tert-butylpiperazin-1-yl)-1,3-thiazole;1-tert-butyl-4-pyridin-2-ylpiperazine;1-tert-butyl-4-pyridin-3-ylpiperazine;1-tert-butyl-4-pyridin-4-ylpiperazine;1-tert-butyl-4-(2-pyrrolidin-1-ylethyl)piperazine
CID 159424819

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine (CID 163856269) is 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine is CC(C)OCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.CCOCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.COCCCNc1nc(N)nc2ccn(Cc3ccccn3)c12.Nc1nc(NCC2CCCO2)c2c(ccn2Cc2ccccn2)n1.Nc1nc(NCc2nccs2)c2c(ccn2Cc2ccccn2)n1.
What is the InChIKey of 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine?
The InChIKey is OYOMSWVIWXTYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O.C17H22N6O.C16H15N7S.2C16H20N6O/c18-17-21-14-6-8-23(11-12-4-1-2-7-19-12)15(14)16(22-17)20-10-13-5-3-9-24-13;1-12(2)24-10-8-20-16-15-14(21-17(18)22-16)6-9-23(15)11-13-5-3-4-7-19-13;17-16-21-12-4-7-23(10-11-3-1-2-5-18-11)14(12)15(22-16)20-9-13-19-6-8-24-13;1-23-10-4-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-2-3-7-18-12;1-2-23-10-8-19-15-14-13(20-16(17)21-15)6-9-22(14)11-12-5-3-4-7-18-12/h1-2,4,6-8,13H,3,5,9-11H2,(H3,18,20,21,22);3-7,9,12H,8,10-11H2,1-2H3,(H3,18,20,21,22);1-8H,9-10H2,(H3,17,20,21,22);2-3,5-7,9H,4,8,10-11H2,1H3,(H3,17,19,20,21);3-7,9H,2,8,10-11H2,1H3,(H3,17,19,20,21).
What are the key properties of 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine?
4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine has a molecular weight of 1612.96 g/mol, XLogP of 10.68, 31 rotatable bonds, 10 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-ethoxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(3-methoxypropyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(oxolan-2-ylmethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;4-N-(2-propan-2-yloxyethyl)-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-(pyridin-2-ylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 163856269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).