2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide

C15H17N3O2 — CID 110014390

IUPAC2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide
SMILESO=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCC1O
InChIInChI=1S/C15H17N3O2/c19-13-3-1-2-12(13)15(20)18-11-6-4-10(5-7-11)14-16-8-9-17-14/h4-9,12-13,19H,1-3H2,(H,16,17)(H,18,20)
InChIKeyOAXALIOESPFKFF-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.18
Rot. Bonds3

About 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide

2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide (PubChem CID 110014390) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide
PubChem CID110014390
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide
SMILESO=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCC1O
InChIInChI=1S/C15H17N3O2/c19-13-3-1-2-12(13)15(20)18-11-6-4-10(5-7-11)14-16-8-9-17-14/h4-9,12-13,19H,1-3H2,(H,16,17)(H,18,20)
InChIKeyOAXALIOESPFKFF-UHFFFAOYSA-N
XLogP2.18
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide (CID 110014390) is 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide is O=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCC1O.
What is the InChIKey of 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The InChIKey is OAXALIOESPFKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-13-3-1-2-12(13)15(20)18-11-6-4-10(5-7-11)14-16-8-9-17-14/h4-9,12-13,19H,1-3H2,(H,16,17)(H,18,20).
What are the key properties of 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide?
2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110014390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).