4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine

C16H17N5 — CID 141030573

IUPAC4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine
SMILESCc1cccc2c1nc(N)n2C1CCCc2nccnc21
InChIInChI=1S/C16H17N5/c1-10-4-2-6-12-14(10)20-16(17)21(12)13-7-3-5-11-15(13)19-9-8-18-11/h2,4,6,8-9,13H,3,5,7H2,1H3,(H2,17,20)
InChIKeyUNWNIAJJIWCABU-UHFFFAOYSA-N
MW279.35 g/mol
LogP2.64
Rot. Bonds1

About 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine

4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine (PubChem CID 141030573) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine
PubChem CID141030573
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine
SMILESCc1cccc2c1nc(N)n2C1CCCc2nccnc21
InChIInChI=1S/C16H17N5/c1-10-4-2-6-12-14(10)20-16(17)21(12)13-7-3-5-11-15(13)19-9-8-18-11/h2,4,6,8-9,13H,3,5,7H2,1H3,(H2,17,20)
InChIKeyUNWNIAJJIWCABU-UHFFFAOYSA-N
XLogP2.64
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine 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

3-(2-amino-4-methylbenzimidazol-1-yl)-1-methylpyrrolidin-2-one
CID 106258960
4-methyl-1-piperidin-4-ylbenzimidazol-2-amine
CID 84793880
1,4-dimethylbenzimidazol-2-amine;dihydrochloride
CID 174932005
7-[1-(2-fluoro-6-methylphenyl)piperidin-4-yl]-3-methyl-5-(5,6,7,8-tetrahydroquinoxalin-5-yl)pyrido[2,3-b]pyrazin-6-one
CID 174277660
3-cycloheptyl-7-methylimidazo[4,5-b]pyridin-2-amine
CID 79288453
2,6-bis(3-methyl-2-pyridinyl)piperidin-1-amine
CID 67421572
4-(aminomethyl)-1-cyclopropylbenzimidazol-2-amine
CID 84776913
N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine
CID 167779946
2-(2-amino-4-fluorobenzimidazol-1-yl)cyclohexan-1-ol
CID 62359258
3-(2-amino-4-methoxybenzimidazol-1-yl)-1-methylpyrrolidin-2-one
CID 106258949
5-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 611416
2-amino-1-(2-methylcyclopentyl)benzimidazole-4-carbonitrile
CID 104718975

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine?
The IUPAC name of 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine (CID 141030573) is 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine?
The canonical SMILES for 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine is Cc1cccc2c1nc(N)n2C1CCCc2nccnc21.
What is the InChIKey of 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine?
The InChIKey is UNWNIAJJIWCABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-10-4-2-6-12-14(10)20-16(17)21(12)13-7-3-5-11-15(13)19-9-8-18-11/h2,4,6,8-9,13H,3,5,7H2,1H3,(H2,17,20).
What are the key properties of 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine?
4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine has a molecular weight of 279.35 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(5,6,7,8-tetrahydroquinoxalin-5-yl)benzimidazol-2-amine is sourced from PubChem (CID 141030573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).