1-(1H-indol-7-yl)benzimidazol-2-amine

C15H12N4 — CID 164628977

IUPAC1-(1H-indol-7-yl)benzimidazol-2-amine
SMILESNc1nc2ccccc2n1-c1cccc2cc[nH]c12
InChIInChI=1S/C15H12N4/c16-15-18-11-5-1-2-6-12(11)19(15)13-7-3-4-10-8-9-17-14(10)13/h1-9,17H,(H2,16,18)
InChIKeyIBUHPFVONCEJCX-UHFFFAOYSA-N
MW248.29 g/mol
LogP3.09
Rot. Bonds1

About 1-(1H-indol-7-yl)benzimidazol-2-amine

1-(1H-indol-7-yl)benzimidazol-2-amine (PubChem CID 164628977) has the molecular formula C15H12N4 and a molecular weight of 248.29 g/mol. Its IUPAC name is 1-(1H-indol-7-yl)benzimidazol-2-amine.

Molecular Properties

Compound Name1-(1H-indol-7-yl)benzimidazol-2-amine
PubChem CID164628977
Molecular FormulaC15H12N4
Molecular Weight248.29 g/mol
Exact Mass248.11
IUPAC Name1-(1H-indol-7-yl)benzimidazol-2-amine
SMILESNc1nc2ccccc2n1-c1cccc2cc[nH]c12
InChIInChI=1S/C15H12N4/c16-15-18-11-5-1-2-6-12(11)19(15)13-7-3-4-10-8-9-17-14(10)13/h1-9,17H,(H2,16,18)
InChIKeyIBUHPFVONCEJCX-UHFFFAOYSA-N
XLogP3.09
TPSA59.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-1-naphthalen-1-ylbenzimidazol-2-amine
CID 43659401
7-pyrrol-1-yl-1H-indole
CID 118078207
[4-(2-aminobenzimidazol-1-yl)naphthalen-1-yl]boronic acid
CID 140707648
2-(2-aminobenzimidazol-1-yl)-4,6-dimethylphenol
CID 164618376
1-(2,5-dimethoxyphenyl)benzimidazol-2-amine
CID 43148885
3-(2-aminobenzimidazol-1-yl)-4-methylbenzonitrile
CID 62104310
4-(2-aminobenzimidazol-1-yl)-3-chlorobenzonitrile
CID 107809094
2-amino-1-(2-methylphenyl)benzimidazol-5-ol
CID 84799586
1-(2-bromophenyl)-5-chlorobenzimidazol-2-amine
CID 43659474
5-fluoro-1-(2-iodophenyl)benzimidazol-2-amine
CID 43661747
1-(2-iodophenyl)-5-methylbenzimidazol-2-amine
CID 43661748
8,15,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(22),2,4,6,9,11,13,16,18,20-decaene
CID 118363229

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-7-yl)benzimidazol-2-amine?
The IUPAC name of 1-(1H-indol-7-yl)benzimidazol-2-amine (CID 164628977) is 1-(1H-indol-7-yl)benzimidazol-2-amine.
What is the SMILES notation for 1-(1H-indol-7-yl)benzimidazol-2-amine?
The canonical SMILES for 1-(1H-indol-7-yl)benzimidazol-2-amine is Nc1nc2ccccc2n1-c1cccc2cc[nH]c12.
What is the InChIKey of 1-(1H-indol-7-yl)benzimidazol-2-amine?
The InChIKey is IBUHPFVONCEJCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4/c16-15-18-11-5-1-2-6-12(11)19(15)13-7-3-4-10-8-9-17-14(10)13/h1-9,17H,(H2,16,18).
What are the key properties of 1-(1H-indol-7-yl)benzimidazol-2-amine?
1-(1H-indol-7-yl)benzimidazol-2-amine has a molecular weight of 248.29 g/mol, XLogP of 3.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-7-yl)benzimidazol-2-amine is sourced from PubChem (CID 164628977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).