N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine

C17H19N3 — CID 115144055

IUPACN,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine
SMILESCN(CCc1ccccc1)c1nc2ccccc2n1C
InChIInChI=1S/C17H19N3/c1-19(13-12-14-8-4-3-5-9-14)17-18-15-10-6-7-11-16(15)20(17)2/h3-11H,12-13H2,1-2H3
InChIKeyMAHKOVDKEJBXKV-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.25
Rot. Bonds4

About N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine

N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine (PubChem CID 115144055) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine
PubChem CID115144055
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine
SMILESCN(CCc1ccccc1)c1nc2ccccc2n1C
InChIInChI=1S/C17H19N3/c1-19(13-12-14-8-4-3-5-9-14)17-18-15-10-6-7-11-16(15)20(17)2/h3-11H,12-13H2,1-2H3
InChIKeyMAHKOVDKEJBXKV-UHFFFAOYSA-N
XLogP3.25
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine?
The IUPAC name of N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine (CID 115144055) is N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine.
What is the SMILES notation for N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine?
The canonical SMILES for N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine is CN(CCc1ccccc1)c1nc2ccccc2n1C.
What is the InChIKey of N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine?
The InChIKey is MAHKOVDKEJBXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-19(13-12-14-8-4-3-5-9-14)17-18-15-10-6-7-11-16(15)20(17)2/h3-11H,12-13H2,1-2H3.
What are the key properties of N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine?
N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine has a molecular weight of 265.36 g/mol, XLogP of 3.25, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine is sourced from PubChem (CID 115144055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).