N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine

C24H23N5O — CID 139346257

IUPACN-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine
SMILESCN(C)Cc1ccc(-c2cnc(NCc3cccc4occc34)n3cncc23)cc1
InChIInChI=1S/C24H23N5O/c1-28(2)15-17-6-8-18(9-7-17)21-13-27-24(29-16-25-14-22(21)29)26-12-19-4-3-5-23-20(19)10-11-30-23/h3-11,13-14,16H,12,15H2,1-2H3,(H,26,27)
InChIKeyGHWBERCUHJFHPC-UHFFFAOYSA-N
MW397.48 g/mol
LogP4.82
Rot. Bonds6

About N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine

N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine (PubChem CID 139346257) has the molecular formula C24H23N5O and a molecular weight of 397.48 g/mol. Its IUPAC name is N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine
PubChem CID139346257
Molecular FormulaC24H23N5O
Molecular Weight397.48 g/mol
Exact Mass397.19
IUPAC NameN-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine
SMILESCN(C)Cc1ccc(-c2cnc(NCc3cccc4occc34)n3cncc23)cc1
InChIInChI=1S/C24H23N5O/c1-28(2)15-17-6-8-18(9-7-17)21-13-27-24(29-16-25-14-22(21)29)26-12-19-4-3-5-23-20(19)10-11-30-23/h3-11,13-14,16H,12,15H2,1-2H3,(H,26,27)
InChIKeyGHWBERCUHJFHPC-UHFFFAOYSA-N
XLogP4.82
TPSA58.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine 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

8-Oxa-14,21,23,28-tetraazapentacyclo[23.3.1.02,7.014,22.015,20]nonacosa-1(28),2(7),3,5,15,17,19,21,25(29),26-decaen-24-one
CID 139593670
4-[8-amino-3-[(6R,8aS)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-6-yl]imidazo[1,5-a]pyrazin-1-yl]-3-ethoxy-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide
CID 77106864
{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-ylmethyl}-pyrimidin-5-yl-amine
CID 11551775
7-(furan-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-amine
CID 2930286
(7-Benzyloxy-1H-indol-3-yl)-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-phenyl]-methanone
CID 10695777
4-Furan-2-yl-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-indole-1-carboxylic acid dimethylamide
CID 10744089
4-Methoxy-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-indole-1-carboxylic acid dimethylamide
CID 10790411
1-Dimethylcarbamoyl-3-[3-methoxy-4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-1H-indole-4-carboxylic acid methyl ester
CID 10815934
2-N-(4-aminocyclohexyl)-6-N-[[4-(furan-2-yl)phenyl]methyl]-9-propan-2-ylpurine-2,6-diamine
CID 20609846
N-(2,6-dimethylbenzyl)-6-(furan-2-yl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine
CID 24890348
[4-[8-Amino-3-(3-hydroxy-3-methylcyclobutyl)imidazo[1,5-a]pyrazin-1-yl]-2-methoxyphenyl]-phenylmethanone
CID 57960964
N2-(4-amino-cyclohexyl)-9-cyclopentyl-N6-(4-furan-2-yl-benzyl)-9H-purine-2,6-diamine
CID 73355077

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine?
The IUPAC name of N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine (CID 139346257) is N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine is CN(C)Cc1ccc(-c2cnc(NCc3cccc4occc34)n3cncc23)cc1.
What is the InChIKey of N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is GHWBERCUHJFHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O/c1-28(2)15-17-6-8-18(9-7-17)21-13-27-24(29-16-25-14-22(21)29)26-12-19-4-3-5-23-20(19)10-11-30-23/h3-11,13-14,16H,12,15H2,1-2H3,(H,26,27).
What are the key properties of N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine?
N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 397.48 g/mol, XLogP of 4.82, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-4-ylmethyl)-8-[4-[(dimethylamino)methyl]phenyl]imidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 139346257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).