7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine

C23H19Cl6I3N10 — CID 159818556

IUPAC7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine
SMILESNc1c(Cl)cc(I)nc1Cl.Nc1c(Cl)ccnc1Cl.[2H]C([2H])([2H])Nc1nc(I)cc(Cl)c1N.[2H]C([2H])([2H])n1cnc2c(Cl)cc(I)nc21
InChIInChI=1S/C7H5ClIN3.C6H7ClIN3.C5H3Cl2IN2.C5H4Cl2N2/c1-12-3-10-6-4(8)2-5(9)11-7(6)12;1-10-6-5(9)3(7)2-4(8)11-6;6-2-1-3(8)10-5(7)4(2)9;6-3-1-2-9-5(7)4(3)8/h2-3H,1H3;2H,9H2,1H3,(H,10,11);1H,9H2;1-2H,8H2/i2*1D3;;
InChIKeyNLXZCAKTGRPYGW-NAXAOJHISA-N
MW1034.94 g/mol
LogP8.74
Rot. Bonds3

About 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine

7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine (PubChem CID 159818556) has the molecular formula C23H19Cl6I3N10 and a molecular weight of 1034.94 g/mol. Its IUPAC name is 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine.

Molecular Properties

Compound Name7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine
PubChem CID159818556
Molecular FormulaC23H19Cl6I3N10
Molecular Weight1034.94 g/mol
Exact Mass1031.74
IUPAC Name7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine
SMILESNc1c(Cl)cc(I)nc1Cl.Nc1c(Cl)ccnc1Cl.[2H]C([2H])([2H])Nc1nc(I)cc(Cl)c1N.[2H]C([2H])([2H])n1cnc2c(Cl)cc(I)nc21
InChIInChI=1S/C7H5ClIN3.C6H7ClIN3.C5H3Cl2IN2.C5H4Cl2N2/c1-12-3-10-6-4(8)2-5(9)11-7(6)12;1-10-6-5(9)3(7)2-4(8)11-6;6-2-1-3(8)10-5(7)4(2)9;6-3-1-2-9-5(7)4(3)8/h2-3H,1H3;2H,9H2,1H3,(H,10,11);1H,9H2;1-2H,8H2/i2*1D3;;
InChIKeyNLXZCAKTGRPYGW-NAXAOJHISA-N
XLogP8.74
TPSA159.47 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001034.94
LogP ≤ 58.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

Imidazo[1,2-a]pyridine deriv. 1c
CID 6539020
Imidazo[1,2-a]pyridine deriv. 1d
CID 6539021
6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-piperidin-3-ylpyridin-2-amine
CID 25169384
6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-piperidin-4-ylpyridin-2-amine
CID 44449050
5-(1-butyl-1H-benzo[d]imidazol-2-yl)-3-chloro-N-(6-methylpyridin-3-yl)pyridin-2-amine
CID 25101881
3-chloro-N-(6-methylpyridin-3-yl)-5-(1-propyl-1H-benzo[d]imidazol-2-yl)pyridin-2-amine
CID 53321433
3-chloro-5-(1-ethyl-1H-benzo[d]imidazol-2-yl)-N-(6-methylpyridin-3-yl)pyridin-2-amine
CID 53324080
3-chloro-5-(1-isobutyl-1H-benzo[d]imidazol-2-yl)-N-(6-methylpyridin-3-yl)pyridin-2-amine
CID 53325366
8-Chloro-9-cyclopentyl-N-(5-(1-piperazinyl)-2-pyridinyl)-9H-pyrido[4',3':4,5]-pyrrolo[2,3-d]pyrimidin-2-amine
CID 58299601
3-[3-[4-(Aminomethyl)phenyl]-5-chloroimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;hydrochloride
CID 60155270
10-chloro-8-cyclopentyl-N-[5-[4-(dimethylamino)piperidin-1-yl]-2-pyridinyl]-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58299831
Imidazo[1,2-a]pyridine deriv. 1b
CID 6539019

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine?
The IUPAC name of 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine (CID 159818556) is 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine.
What is the SMILES notation for 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine?
The canonical SMILES for 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine is Nc1c(Cl)cc(I)nc1Cl.Nc1c(Cl)ccnc1Cl.[2H]C([2H])([2H])Nc1nc(I)cc(Cl)c1N.[2H]C([2H])([2H])n1cnc2c(Cl)cc(I)nc21.
What is the InChIKey of 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine?
The InChIKey is NLXZCAKTGRPYGW-NAXAOJHISA-N. The full InChI is InChI=1S/C7H5ClIN3.C6H7ClIN3.C5H3Cl2IN2.C5H4Cl2N2/c1-12-3-10-6-4(8)2-5(9)11-7(6)12;1-10-6-5(9)3(7)2-4(8)11-6;6-2-1-3(8)10-5(7)4(2)9;6-3-1-2-9-5(7)4(3)8/h2-3H,1H3;2H,9H2,1H3,(H,10,11);1H,9H2;1-2H,8H2/i2*1D3;;.
What are the key properties of 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine?
7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine has a molecular weight of 1034.94 g/mol, XLogP of 8.74, 3 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-iodo-3-(trideuteriomethyl)imidazo[4,5-b]pyridine;4-chloro-6-iodo-2-N-(trideuteriomethyl)pyridine-2,3-diamine;2,4-dichloro-6-iodopyridin-3-amine;2,4-dichloropyridin-3-amine is sourced from PubChem (CID 159818556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).