N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

C16H18N2O3 — CID 6619102

IUPACN-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)NC3CCCC3)no2)cc1
InChIInChI=1S/C16H18N2O3/c1-20-13-8-6-11(7-9-13)15-10-14(18-21-15)16(19)17-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,17,19)
InChIKeyAYXMIAGJYPLPOL-UHFFFAOYSA-N
MW286.33 g/mol
LogP3.02
Rot. Bonds4

About N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 6619102) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
PubChem CID6619102
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)NC3CCCC3)no2)cc1
InChIInChI=1S/C16H18N2O3/c1-20-13-8-6-11(7-9-13)15-10-14(18-21-15)16(19)17-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,17,19)
InChIKeyAYXMIAGJYPLPOL-UHFFFAOYSA-N
XLogP3.02
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 1093781
5-(4-Methoxyphenyl)-3-[(pyrrolidin-1-yl)carbonyl]-1,2-oxazole
CID 6619182
4-{[5-(4-Methoxyphenyl)-1,2-oxazol-3-yl]carbonyl}morpholine
CID 17252835
N-cyclohexyl-5-(4-methylphenyl)-3-isoxazolecarboxamide
CID 1093785
N-(4-methoxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093730
N-cyclopentyl-5-(4-fluorophenyl)isoxazole-3-carboxamide
CID 17252686
N-[(1S)-2-[(4-methoxy-2,5-dimethylphenyl)methylamino]-1-phenylethyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 118796836
N-(3-(2-hydroxynicotinamido)propyl)-5-phenylisoxazole-3-carboxamide
CID 60167648
N-cyclopentyl-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093736
N-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 1093771
N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide
CID 3158158
N-allyl-5-(1,3-benzodioxol-5-yl)isoxazole-3-carboxamide
CID 3423164

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide (CID 6619102) is N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide is COc1ccc(-c2cc(C(=O)NC3CCCC3)no2)cc1.
What is the InChIKey of N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is AYXMIAGJYPLPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-20-13-8-6-11(7-9-13)15-10-14(18-21-15)16(19)17-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,17,19).
What are the key properties of N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide?
N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 6619102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).