1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol

C14H19N3O — CID 62589071

IUPAC1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol
SMILESCC(O)c1nc2cc(N)ccc2n1C1CCCC1
InChIInChI=1S/C14H19N3O/c1-9(18)14-16-12-8-10(15)6-7-13(12)17(14)11-4-2-3-5-11/h6-9,11,18H,2-5,15H2,1H3
InChIKeyOQDHBFGULYPCBM-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.79
Rot. Bonds2

About 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol

1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol (PubChem CID 62589071) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol
PubChem CID62589071
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol
SMILESCC(O)c1nc2cc(N)ccc2n1C1CCCC1
InChIInChI=1S/C14H19N3O/c1-9(18)14-16-12-8-10(15)6-7-13(12)17(14)11-4-2-3-5-11/h6-9,11,18H,2-5,15H2,1H3
InChIKeyOQDHBFGULYPCBM-UHFFFAOYSA-N
XLogP2.79
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-[5-amino-1-(1-methylpiperidin-3-yl)benzimidazol-2-yl]ethanol
CID 62594160
5-[5-amino-2-(1-hydroxyethyl)benzimidazol-1-yl]piperidin-2-one
CID 63662334
1-[5-amino-1-(cyclobutylmethyl)benzimidazol-2-yl]ethanol
CID 62595452
1-cyclohexylbenzimidazole-2,5-diamine
CID 84793894
1-(4-ethylcyclohexyl)-2-propan-2-ylbenzimidazol-5-amine
CID 63497047
1-cyclopropyl-2-[(1S)-1-hydroxyethyl]benzimidazole-5-carbonitrile
CID 66263871
1-cyclopentyl-2-(2,2-dimethylpropyl)benzimidazol-5-amine
CID 96668227
[2-(5-amino-2-propan-2-ylbenzimidazol-1-yl)cyclohexyl]methanol
CID 106364825
1-(1-ethylpiperidin-3-yl)-2-propan-2-ylbenzimidazol-5-amine
CID 62507406
3-[[5-amino-2-(1-hydroxyethyl)benzimidazol-1-yl]methyl]cyclohexan-1-ol
CID 106137531
1-[5-amino-1-(3,5-dimethylphenyl)benzimidazol-2-yl]ethanol
CID 62596546
1-cyclohexyl-2-propylbenzimidazol-5-amine
CID 62507665

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol?
The IUPAC name of 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol (CID 62589071) is 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol?
The canonical SMILES for 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol is CC(O)c1nc2cc(N)ccc2n1C1CCCC1.
What is the InChIKey of 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol?
The InChIKey is OQDHBFGULYPCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-9(18)14-16-12-8-10(15)6-7-13(12)17(14)11-4-2-3-5-11/h6-9,11,18H,2-5,15H2,1H3.
What are the key properties of 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol?
1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol has a molecular weight of 245.33 g/mol, XLogP of 2.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-1-cyclopentylbenzimidazol-2-yl)ethanol is sourced from PubChem (CID 62589071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).