2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine

C12H17N3 — CID 53211283

IUPAC2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine
SMILESCCc1nc2ccccc2n1CCNC
InChIInChI=1S/C12H17N3/c1-3-12-14-10-6-4-5-7-11(10)15(12)9-8-13-2/h4-7,13H,3,8-9H2,1-2H3
InChIKeyGKULBOQWOQARNX-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.82
Rot. Bonds4

About 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine

2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine (PubChem CID 53211283) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine
PubChem CID53211283
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine
SMILESCCc1nc2ccccc2n1CCNC
InChIInChI=1S/C12H17N3/c1-3-12-14-10-6-4-5-7-11(10)15(12)9-8-13-2/h4-7,13H,3,8-9H2,1-2H3
InChIKeyGKULBOQWOQARNX-UHFFFAOYSA-N
XLogP1.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-ethylbenzimidazol-1-yl)ethyl]-N',N'-dimethylethane-1,2-diamine
CID 63106194
N-(2-butoxyethyl)-2-(2-ethylbenzimidazol-1-yl)ethanamine
CID 63107484
N-[3-(2-ethylbenzimidazol-1-yl)propyl]aniline
CID 63105255
N-methyl-4-(1-propylbenzimidazol-2-yl)butan-1-amine
CID 79750802
1-(3,3-dimethylbutyl)-2-ethylbenzimidazole
CID 115582370
N-[2-(2-ethylbenzimidazol-1-yl)ethyl]-3-methylaniline
CID 63106920
2-ethyl-1-(2-ethylsulfanylethyl)benzimidazole
CID 116622472
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
N-[3-(2-ethylbenzimidazol-1-yl)propyl]cyclopropanamine
CID 63106717
N-[2-(2-ethylbenzimidazol-1-yl)ethyl]-1-(furan-2-yl)ethanamine
CID 63105832
N,N'-dimethyl-N'-[(1-propylbenzimidazol-2-yl)methyl]ethane-1,2-diamine
CID 79753322
N-benzyl-4-(2-ethylbenzimidazol-1-yl)butan-1-amine
CID 134815891

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine (CID 53211283) is 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine is CCc1nc2ccccc2n1CCNC.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine?
The InChIKey is GKULBOQWOQARNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-3-12-14-10-6-4-5-7-11(10)15(12)9-8-13-2/h4-7,13H,3,8-9H2,1-2H3.
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine?
2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine has a molecular weight of 203.29 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-N-methylethanamine is sourced from PubChem (CID 53211283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).