4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide

C10H13ClN2O2 — CID 126457824

IUPAC4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide
SMILESCc1noc(C(=O)NC2CCCC2)c1Cl
InChIInChI=1S/C10H13ClN2O2/c1-6-8(11)9(15-13-6)10(14)12-7-4-2-3-5-7/h7H,2-5H2,1H3,(H,12,14)
InChIKeyQQXCUTMKNHMWNQ-UHFFFAOYSA-N
MW228.68 g/mol
LogP2.31
Rot. Bonds2

About 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide

4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide (PubChem CID 126457824) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide
PubChem CID126457824
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide
SMILESCc1noc(C(=O)NC2CCCC2)c1Cl
InChIInChI=1S/C10H13ClN2O2/c1-6-8(11)9(15-13-6)10(14)12-7-4-2-3-5-7/h7H,2-5H2,1H3,(H,12,14)
InChIKeyQQXCUTMKNHMWNQ-UHFFFAOYSA-N
XLogP2.31
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cycloheptyl-4-methyl-1,3-thiazole-5-carboxamide
CID 91821812
(4-chloro-3-methyl-1,2-oxazol-5-yl)-(2,6-dimethylpiperidin-1-yl)methanone
CID 20868361
N-cyclohexyl-4-methyl-1,2-oxazole-3-carboxamide
CID 110848900
N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide
CID 110848761
(4-chloro-3-methyl-1,2-oxazol-5-yl)-piperidin-1-ylmethanone
CID 20868367
3-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63044187
N-cyclopentyl-6-methyl-4-oxa-2,5-diazatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraene-8-carboxamide
CID 86207454
5-chloro-N-cyclobutyl-3,4,6-trimethylthieno[2,3-b]pyridine-2-carboxamide
CID 121479860
N-cyclopentyl-1,3-dimethyl-4-nitropyrazole-5-carboxamide
CID 19578053
3-tert-butyl-N-cycloheptyl-5-methyl-1,2-oxazole-4-carboxamide
CID 110415381
N-(4-hydroxycyclohexyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 43389638
5-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-cyclobutyl-1,2-oxazole-3-carboxamide
CID 24817014

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide?
The IUPAC name of 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide (CID 126457824) is 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide?
The canonical SMILES for 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide is Cc1noc(C(=O)NC2CCCC2)c1Cl.
What is the InChIKey of 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide?
The InChIKey is QQXCUTMKNHMWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-6-8(11)9(15-13-6)10(14)12-7-4-2-3-5-7/h7H,2-5H2,1H3,(H,12,14).
What are the key properties of 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide?
4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-cyclopentyl-3-methyl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 126457824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).