4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile

C10H10N4O — CID 73013649

IUPAC4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile
SMILESCc1[nH]c2[nH]c(=O)c(C#N)c(N)c2c1C
InChIInChI=1S/C10H10N4O/c1-4-5(2)13-9-7(4)8(12)6(3-11)10(15)14-9/h1-2H3,(H4,12,13,14,15)
InChIKeyHLISKILURFOEKS-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.93
Rot. Bonds

About 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile

4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile (PubChem CID 73013649) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile
PubChem CID73013649
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile
SMILESCc1[nH]c2[nH]c(=O)c(C#N)c(N)c2c1C
InChIInChI=1S/C10H10N4O/c1-4-5(2)13-9-7(4)8(12)6(3-11)10(15)14-9/h1-2H3,(H4,12,13,14,15)
InChIKeyHLISKILURFOEKS-UHFFFAOYSA-N
XLogP0.93
TPSA98.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile 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

5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-ol
CID 135578192
3-Cyano-4,5-dimethyl-2-pyrroloxamic acid
CID 324401
N-(3-cyano-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrol-2-yl)acetamide
CID 670431
1-Acetyl-2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
CID 12234062
2,5,6-Trimethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 135730205
2-Diethylamino-acetamido-3-cyano-4,5-di-methylpyrrole
CID 191933
N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide
CID 4435711
2-(1,3-Dioxobutylamino)-3-cyano-4,5,6,7-tetrahydroindole
CID 14363550
N-(3-cyano-4,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
CID 135650107
Methyl nitrile lidocaine analog
CID 191932
N-(3-cyano-4,5-dimethylpyrrol-2-yl)acetamide
CID 4271700
N-(3-cyano-4,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
CID 16763070

Frequently Asked Questions

What is the IUPAC name of 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile?
The IUPAC name of 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile (CID 73013649) is 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile.
What is the SMILES notation for 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile?
The canonical SMILES for 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile is Cc1[nH]c2[nH]c(=O)c(C#N)c(N)c2c1C.
What is the InChIKey of 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile?
The InChIKey is HLISKILURFOEKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-4-5(2)13-9-7(4)8(12)6(3-11)10(15)14-9/h1-2H3,(H4,12,13,14,15).
What are the key properties of 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile?
4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile has a molecular weight of 202.22 g/mol, XLogP of 0.93, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,3-dimethyl-6-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile is sourced from PubChem (CID 73013649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).