6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one

C20H20N6O2 — CID 146339129

IUPAC6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one
SMILESCNc1cc(C)nc(Nc2ccc(OC)c(-c3cc4c(cn3)CC(=O)N4)c2)n1
InChIInChI=1S/C20H20N6O2/c1-11-6-18(21-2)26-20(23-11)24-13-4-5-17(28-3)14(8-13)16-9-15-12(10-22-16)7-19(27)25-15/h4-6,8-10H,7H2,1-3H3,(H,25,27)(H2,21,23,24,26)
InChIKeyPXPYCBAMWXQWJW-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.14
Rot. Bonds5

About 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one

6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one (PubChem CID 146339129) has the molecular formula C20H20N6O2 and a molecular weight of 376.42 g/mol. Its IUPAC name is 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one.

Molecular Properties

Compound Name6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one
PubChem CID146339129
Molecular FormulaC20H20N6O2
Molecular Weight376.42 g/mol
Exact Mass376.16
IUPAC Name6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one
SMILESCNc1cc(C)nc(Nc2ccc(OC)c(-c3cc4c(cn3)CC(=O)N4)c2)n1
InChIInChI=1S/C20H20N6O2/c1-11-6-18(21-2)26-20(23-11)24-13-4-5-17(28-3)14(8-13)16-9-15-12(10-22-16)7-19(27)25-15/h4-6,8-10H,7H2,1-3H3,(H,25,27)(H2,21,23,24,26)
InChIKeyPXPYCBAMWXQWJW-UHFFFAOYSA-N
XLogP3.14
TPSA101.06 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one 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

2-N-(3-furo[2,3-c]pyridin-5-yl-4-methoxyphenyl)-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146339143
2-N-[3-(3-fluoro-1H-pyrrolo[3,2-c]pyridin-6-yl)-4-methoxyphenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146339005
2-N-[3-(1H-indazol-4-yl)-4-methoxyphenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 135154278
2-N-[4-methoxy-3-(3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 135154251
2-N-[4-methoxy-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146338924
2-N-(3-hydrazinyl-4-methoxyphenyl)-4-N,6-dimethylpyrimidine-2,4-diamine
CID 135154230
2-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 162651371
2-N-[4-methoxy-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146339135
2-N-[4-methoxy-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146338952
2-N-[4-methoxy-3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 146397993
2-(3-fluoro-4-methoxyanilino)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one
CID 59851961
2-N-[4-methoxy-3-[3-(methylamino)cyclobutyl]oxyphenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 145385464

Frequently Asked Questions

What is the IUPAC name of 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one?
The IUPAC name of 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one (CID 146339129) is 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one.
What is the SMILES notation for 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one?
The canonical SMILES for 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one is CNc1cc(C)nc(Nc2ccc(OC)c(-c3cc4c(cn3)CC(=O)N4)c2)n1.
What is the InChIKey of 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one?
The InChIKey is PXPYCBAMWXQWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O2/c1-11-6-18(21-2)26-20(23-11)24-13-4-5-17(28-3)14(8-13)16-9-15-12(10-22-16)7-19(27)25-15/h4-6,8-10H,7H2,1-3H3,(H,25,27)(H2,21,23,24,26).
What are the key properties of 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one?
6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one has a molecular weight of 376.42 g/mol, XLogP of 3.14, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenyl]-1,3-dihydropyrrolo[3,2-c]pyridin-2-one is sourced from PubChem (CID 146339129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).