7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide

C16H15N3O2 — CID 62057891

IUPAC7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3cccc(N)c3[nH]2)cc1
InChIInChI=1S/C16H15N3O2/c1-21-12-7-5-11(6-8-12)18-16(20)14-9-10-3-2-4-13(17)15(10)19-14/h2-9,19H,17H2,1H3,(H,18,20)
InChIKeyZXNRBMJIQVSBSZ-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.01
Rot. Bonds3

About 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide

7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide (PubChem CID 62057891) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide
PubChem CID62057891
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3cccc(N)c3[nH]2)cc1
InChIInChI=1S/C16H15N3O2/c1-21-12-7-5-11(6-8-12)18-16(20)14-9-10-3-2-4-13(17)15(10)19-14/h2-9,19H,17H2,1H3,(H,18,20)
InChIKeyZXNRBMJIQVSBSZ-UHFFFAOYSA-N
XLogP3.01
TPSA80.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide 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-amino-N-(4-chlorophenyl)-1H-indole-2-carboxamide
CID 63117531
7-amino-N-[4-[(E)-N-(1-aminoethylideneamino)-C-methylcarbonimidoyl]phenyl]-1H-indole-2-carboxamide
CID 172922337
methyl 7-amino-1H-indole-2-carboxylate
CID 18550972
7-amino-N-(3-fluoro-5-methylphenyl)-1H-indole-2-carboxamide
CID 79041127
7-methoxy-N-phenyl-1H-indole-2-carboxamide
CID 110856487
7-amino-N-(4,6-dimethyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 114931643
7-amino-N-(2-chloro-6-methylphenyl)-1H-indole-2-carboxamide
CID 66251996
7-amino-N-propyl-1H-indole-2-carboxamide
CID 62056831
7-amino-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 63117500
7-chloro-N-(3-chloro-4-methoxyphenyl)-1H-indole-2-carboxamide
CID 108791613
7-amino-N-(1-methylpyrazol-3-yl)-1H-indole-2-carboxamide
CID 62058461
7-amino-N-(4-bromo-2-methylphenyl)-1H-indole-2-carboxamide
CID 63117458

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide?
The IUPAC name of 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide (CID 62057891) is 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide?
The canonical SMILES for 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide is COc1ccc(NC(=O)c2cc3cccc(N)c3[nH]2)cc1.
What is the InChIKey of 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide?
The InChIKey is ZXNRBMJIQVSBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-21-12-7-5-11(6-8-12)18-16(20)14-9-10-3-2-4-13(17)15(10)19-14/h2-9,19H,17H2,1H3,(H,18,20).
What are the key properties of 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide?
7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 3.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 62057891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).