N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine

C15H15N3 — CID 115143817

IUPACN-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine
SMILESCc1cccc(N(C)c2nc3ccccc3[nH]2)c1
InChIInChI=1S/C15H15N3/c1-11-6-5-7-12(10-11)18(2)15-16-13-8-3-4-9-14(13)17-15/h3-10H,1-2H3,(H,16,17)
InChIKeyBEPGSPKVYLYYPS-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.64
Rot. Bonds2

About N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine

N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine (PubChem CID 115143817) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine
PubChem CID115143817
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC NameN-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine
SMILESCc1cccc(N(C)c2nc3ccccc3[nH]2)c1
InChIInChI=1S/C15H15N3/c1-11-6-5-7-12(10-11)18(2)15-16-13-8-3-4-9-14(13)17-15/h3-10H,1-2H3,(H,16,17)
InChIKeyBEPGSPKVYLYYPS-UHFFFAOYSA-N
XLogP3.64
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine
CID 115143824
N-(2-methoxyethyl)-N-methyl-1H-benzimidazol-2-amine
CID 133409792
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
CID 90287555
N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
CID 115143834
1-(1H-benzimidazol-2-yl)-1-[2-(3-methylphenyl)ethyl]thiourea
CID 151046273
methyl N-(1H-benzimidazol-2-yl)-N-methylcarbamate
CID 69230726
2-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole
CID 43236517
N-(2,6-dibromophenyl)-N-phenyl-1H-benzimidazol-2-amine
CID 126746904
2-(N,3-dimethylanilino)-1H-indole-3-carbonitrile
CID 115146365
N-methyl-N-(3-methylphenyl)pyridin-4-amine
CID 89072633
N-ethyl-N-(3-methylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 110757297

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine?
The IUPAC name of N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine (CID 115143817) is N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine.
What is the SMILES notation for N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine?
The canonical SMILES for N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine is Cc1cccc(N(C)c2nc3ccccc3[nH]2)c1.
What is the InChIKey of N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine?
The InChIKey is BEPGSPKVYLYYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11-6-5-7-12(10-11)18(2)15-16-13-8-3-4-9-14(13)17-15/h3-10H,1-2H3,(H,16,17).
What are the key properties of N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine?
N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine has a molecular weight of 237.31 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine is sourced from PubChem (CID 115143817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).