N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide

C16H17FN2O2 — CID 167971710

IUPACN-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide
SMILESCc1nocc1C(=O)NC1CCC(c2cccc(F)c2)C1
InChIInChI=1S/C16H17FN2O2/c1-10-15(9-21-19-10)16(20)18-14-6-5-12(8-14)11-3-2-4-13(17)7-11/h2-4,7,9,12,14H,5-6,8H2,1H3,(H,18,20)
InChIKeyUMLDELCBBUSABY-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.19
Rot. Bonds3

About N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide

N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide (PubChem CID 167971710) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide
PubChem CID167971710
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC NameN-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide
SMILESCc1nocc1C(=O)NC1CCC(c2cccc(F)c2)C1
InChIInChI=1S/C16H17FN2O2/c1-10-15(9-21-19-10)16(20)18-14-6-5-12(8-14)11-3-2-4-13(17)7-11/h2-4,7,9,12,14H,5-6,8H2,1H3,(H,18,20)
InChIKeyUMLDELCBBUSABY-UHFFFAOYSA-N
XLogP3.19
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,3R)-3-(3-fluorophenyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 129479935
1-(3-aminocyclohexyl)-3-[3-(3-fluorophenyl)cyclopentyl]urea
CID 128811232
1-[(1S,3R)-3-(3-fluorophenyl)cyclopentyl]-3-(1-methylindazol-4-yl)urea
CID 66550281
4-(3-fluorophenyl)-N-methylcyclohexan-1-amine
CID 82283505
4-[[[3-(3-fluorophenyl)cyclopentyl]amino]methyl]benzoic acid
CID 122033757
N-[3-(3-fluorophenyl)cyclobutyl]-2-oxo-1H-pyridine-4-carboxamide
CID 138044557
3-(dimethylsulfamoyl)-N-[2-[[3-(3-fluorophenyl)cyclopentyl]amino]-2-oxoethyl]benzamide
CID 146127558
N-[3-(3-fluorophenyl)cyclobutyl]hydroxylamine
CID 82686213
N-[4-[[6-chloro-2-(trifluoromethyl)quinolin-4-yl]amino]cyclohexyl]-3-methyl-1,2-oxazole-4-carboxamide
CID 163267125
N-cyclopropyl-4-fluoro-2-methoxybenzamide
CID 162421278
[6-chloro-7-[4-[[3-(3-fluorophenyl)cyclopentyl]carbamoyl]phenoxy]-3,4-dihydro-2H-chromen-4-yl] hydrogen carbonate
CID 90340054
2-[[3-(3-fluorophenyl)cyclobutyl]amino]propanamide
CID 43635571

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide (CID 167971710) is N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide is Cc1nocc1C(=O)NC1CCC(c2cccc(F)c2)C1.
What is the InChIKey of N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide?
The InChIKey is UMLDELCBBUSABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-10-15(9-21-19-10)16(20)18-14-6-5-12(8-14)11-3-2-4-13(17)7-11/h2-4,7,9,12,14H,5-6,8H2,1H3,(H,18,20).
What are the key properties of N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide?
N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide has a molecular weight of 288.32 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluorophenyl)cyclopentyl]-3-methyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 167971710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).