1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine

C11H15N3 — CID 82490893

IUPAC1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine
SMILESCCn1cnc2cc(CNC)ccc21
InChIInChI=1S/C11H15N3/c1-3-14-8-13-10-6-9(7-12-2)4-5-11(10)14/h4-6,8,12H,3,7H2,1-2H3
InChIKeyLOIRJPCWQUTYPQ-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.78
Rot. Bonds3

About 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine

1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine (PubChem CID 82490893) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine
PubChem CID82490893
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine
SMILESCCn1cnc2cc(CNC)ccc21
InChIInChI=1S/C11H15N3/c1-3-14-8-13-10-6-9(7-12-2)4-5-11(10)14/h4-6,8,12H,3,7H2,1-2H3
InChIKeyLOIRJPCWQUTYPQ-UHFFFAOYSA-N
XLogP1.78
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylbenzimidazol-5-yl)-N-methylethanamine
CID 82491787
5-(1-ethylbenzimidazol-5-yl)pentan-1-amine
CID 98783919
N-[(1-ethylbenzimidazol-5-yl)methyl]thiophene-3-carboxamide
CID 50844685
1-ethylbenzimidazol-5-amine;dihydrochloride
CID 46735992
1-ethyl-N-(pyridin-4-ylmethyl)benzimidazol-5-amine
CID 866291
1-ethyl-5-isocyanobenzimidazole
CID 140845990
1-ethylbenzimidazole-5-carbonitrile;1-methylbenzimidazole-5-carbonitrile
CID 67607206
N-[(1-propylbenzimidazol-5-yl)methyl]-4-(trifluoromethyl)benzamide
CID 50844722
N-(1-ethylbenzimidazol-5-yl)butanamide
CID 2973046
1-ethyl-5-(trifluoromethylsulfonyl)benzimidazole
CID 22903244
N-[(1-propan-2-ylbenzimidazol-5-yl)methyl]ethanamine
CID 82493458
N-[(2,4-dichlorophenyl)methyl]-1-ethylbenzimidazol-5-amine
CID 22427243

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine (CID 82490893) is 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine is CCn1cnc2cc(CNC)ccc21.
What is the InChIKey of 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine?
The InChIKey is LOIRJPCWQUTYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-3-14-8-13-10-6-9(7-12-2)4-5-11(10)14/h4-6,8,12H,3,7H2,1-2H3.
What are the key properties of 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine?
1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine has a molecular weight of 189.26 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylbenzimidazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 82490893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).