(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide

C16H18ClN3O2 — CID 136587530

IUPAC(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide
SMILESO=C(N[C@@H]1CCC[C@@H]1n1ccnc1)[C@H](O)c1ccccc1Cl
InChIInChI=1S/C16H18ClN3O2/c17-12-5-2-1-4-11(12)15(21)16(22)19-13-6-3-7-14(13)20-9-8-18-10-20/h1-2,4-5,8-10,13-15,21H,3,6-7H2,(H,19,22)/t13-,14+,15-/m1/s1
InChIKeyRVDWFGUZDRPHPQ-QLFBSQMISA-N
MW319.79 g/mol
LogP2.48
Rot. Bonds4

About (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide

(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide (PubChem CID 136587530) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide
PubChem CID136587530
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC Name(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide
SMILESO=C(N[C@@H]1CCC[C@@H]1n1ccnc1)[C@H](O)c1ccccc1Cl
InChIInChI=1S/C16H18ClN3O2/c17-12-5-2-1-4-11(12)15(21)16(22)19-13-6-3-7-14(13)20-9-8-18-10-20/h1-2,4-5,8-10,13-15,21H,3,6-7H2,(H,19,22)/t13-,14+,15-/m1/s1
InChIKeyRVDWFGUZDRPHPQ-QLFBSQMISA-N
XLogP2.48
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide
CID 65229653
2-amino-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 43713486
1-(3-chloro-4-pyrazol-1-ylphenyl)-3-[(1R,2S)-2-imidazol-1-ylcyclopentyl]urea
CID 96529213
2-bromo-4-chloro-N-(2-imidazol-1-ylcyclopentyl)benzamide
CID 103763911
(2R)-2-amino-N-(2-imidazol-1-ylcyclopentyl)-4-methylsulfanylbutanamide
CID 104907460
N-(2-imidazol-1-ylcyclopentyl)-2-(methylamino)acetamide
CID 43713522
5-chloro-N-(2-imidazol-1-ylcyclopentyl)pentanamide
CID 43701618
2-bromo-N-(2-imidazol-1-ylcyclopentyl)pyridine-4-carboxamide
CID 103755463
N-[2-[(2-imidazol-1-ylcyclopentyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 60512615
N-(2-imidazol-1-ylcyclopentyl)piperidine-3-carboxamide
CID 43713483
2-imidazol-1-yl-N-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 43734309
N-[(2-bromophenyl)methyl]-2-imidazol-1-ylcyclopentan-1-amine
CID 43734382

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide?
The IUPAC name of (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide (CID 136587530) is (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide.
What is the SMILES notation for (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide?
The canonical SMILES for (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide is O=C(N[C@@H]1CCC[C@@H]1n1ccnc1)[C@H](O)c1ccccc1Cl.
What is the InChIKey of (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide?
The InChIKey is RVDWFGUZDRPHPQ-QLFBSQMISA-N. The full InChI is InChI=1S/C16H18ClN3O2/c17-12-5-2-1-4-11(12)15(21)16(22)19-13-6-3-7-14(13)20-9-8-18-10-20/h1-2,4-5,8-10,13-15,21H,3,6-7H2,(H,19,22)/t13-,14+,15-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide?
(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide has a molecular weight of 319.79 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide is sourced from PubChem (CID 136587530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).