4-methyl-7-(methylamino)-1H-indole-3-carbonitrile

C11H11N3 — CID 139366191

IUPAC4-methyl-7-(methylamino)-1H-indole-3-carbonitrile
SMILESCNc1ccc(C)c2c(C#N)c[nH]c12
InChIInChI=1S/C11H11N3/c1-7-3-4-9(13-2)11-10(7)8(5-12)6-14-11/h3-4,6,13-14H,1-2H3
InChIKeyYJOFYITVCPOTEP-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.39
Rot. Bonds1

About 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile

4-methyl-7-(methylamino)-1H-indole-3-carbonitrile (PubChem CID 139366191) has the molecular formula C11H11N3 and a molecular weight of 185.23 g/mol. Its IUPAC name is 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile.

Molecular Properties

Compound Name4-methyl-7-(methylamino)-1H-indole-3-carbonitrile
PubChem CID139366191
Molecular FormulaC11H11N3
Molecular Weight185.23 g/mol
Exact Mass185.10
IUPAC Name4-methyl-7-(methylamino)-1H-indole-3-carbonitrile
SMILESCNc1ccc(C)c2c(C#N)c[nH]c12
InChIInChI=1S/C11H11N3/c1-7-3-4-9(13-2)11-10(7)8(5-12)6-14-11/h3-4,6,13-14H,1-2H3
InChIKeyYJOFYITVCPOTEP-UHFFFAOYSA-N
XLogP2.39
TPSA51.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-methyl-7-(methylamino)-1H-indole-3-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

7-[(4-cyanophenyl)sulfanylamino]-4-methyl-1H-indole-3-carbonitrile
CID 153329674
7-[(4-ethylphenyl)sulfanylamino]-4-methyl-1H-indole-3-carbonitrile
CID 142616692
4-methyl-7-(1,2-thiazol-4-ylsulfanylamino)-1H-indole-3-carbonitrile
CID 170949637
7-[(5-bromo-1,3-thiazol-2-yl)sulfanylamino]-4-methyl-1H-indole-3-carbonitrile
CID 170949865
4-methyl-7-(1-naphthalen-2-ylethylamino)-1H-indole-3-carbonitrile
CID 166342846
N-(3-cyano-4-methyl-1H-indol-7-yl)-3-methyl-1,2-thiazole-5-sulfonamide
CID 171055436
7-(1,3-benzothiazol-2-ylsulfanylamino)-4-methyl-1H-indole-3-carbonitrile
CID 170949597
N-(3-cyano-4-methyl-1H-indol-7-yl)-4-phenoxybenzenesulfonamide
CID 155116684
7-[(2-ethyl-1,3-thiazol-5-yl)sulfanylamino]-4-methyl-1H-indole-3-carbonitrile
CID 170949685
N-(3-cyano-4-methyl-1H-indol-7-yl)-4-[(Z)-1,2-diaminoethenyl]benzenesulfonamide
CID 174263047
7-[[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]amino]-4-methyl-1H-indole-3-carbonitrile
CID 167805481
7-[(1-ethyl-2-methylimidazol-4-yl)sulfanylamino]-4-methyl-1H-indole-3-carbonitrile
CID 170949765

Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile?
The IUPAC name of 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile (CID 139366191) is 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile.
What is the SMILES notation for 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile?
The canonical SMILES for 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile is CNc1ccc(C)c2c(C#N)c[nH]c12.
What is the InChIKey of 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile?
The InChIKey is YJOFYITVCPOTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3/c1-7-3-4-9(13-2)11-10(7)8(5-12)6-14-11/h3-4,6,13-14H,1-2H3.
What are the key properties of 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile?
4-methyl-7-(methylamino)-1H-indole-3-carbonitrile has a molecular weight of 185.23 g/mol, XLogP of 2.39, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-(methylamino)-1H-indole-3-carbonitrile is sourced from PubChem (CID 139366191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).