N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine

C15H15N3O — CID 115143824

IUPACN-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine
SMILESCOc1ccccc1N(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H15N3O/c1-18(13-9-5-6-10-14(13)19-2)15-16-11-7-3-4-8-12(11)17-15/h3-10H,1-2H3,(H,16,17)
InChIKeyXUDUGURGMMKMGK-UHFFFAOYSA-N
MW253.31 g/mol
LogP3.34
Rot. Bonds3

About N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine

N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine (PubChem CID 115143824) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine
PubChem CID115143824
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine
SMILESCOc1ccccc1N(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H15N3O/c1-18(13-9-5-6-10-14(13)19-2)15-16-11-7-3-4-8-12(11)17-15/h3-10H,1-2H3,(H,16,17)
InChIKeyXUDUGURGMMKMGK-UHFFFAOYSA-N
XLogP3.34
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-benzimidazol-2-yl)-2-methoxy-N-methylbenzamide
CID 90027417
N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
N-methyl-N-(3-methylphenyl)-1H-benzimidazol-2-amine
CID 115143817
methyl N-(1H-benzimidazol-2-yl)-N-methylcarbamate
CID 69230726
N-(2-methoxyethyl)-N-methyl-1H-benzimidazol-2-amine
CID 133409792
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
CID 90287555
2-[(2-methoxyphenyl)methylsulfanyl]-1H-benzimidazole
CID 752044
2-[(2,6-dimethoxyphenyl)methyl]-1H-benzimidazole
CID 139695649
N-methyl-N-(4-nitrophenyl)-1H-benzimidazol-2-amine
CID 58577716
N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
CID 115143834
1-[1H-benzimidazol-2-yl(methyl)amino]-3-methoxypropan-2-ol
CID 55125582
2-chloro-N-(2-methoxyphenyl)-N-methylquinazolin-4-amine
CID 11266548

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine?
The IUPAC name of N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine (CID 115143824) is N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine.
What is the SMILES notation for N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine?
The canonical SMILES for N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine is COc1ccccc1N(C)c1nc2ccccc2[nH]1.
What is the InChIKey of N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine?
The InChIKey is XUDUGURGMMKMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18(13-9-5-6-10-14(13)19-2)15-16-11-7-3-4-8-12(11)17-15/h3-10H,1-2H3,(H,16,17).
What are the key properties of N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine?
N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine has a molecular weight of 253.31 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine is sourced from PubChem (CID 115143824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).