N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide

C20H24FN3O2 — CID 91836336

IUPACN-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
SMILESO=C(NCc1cc(-c2ccc(F)cc2)no1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C20H24FN3O2/c21-16-7-5-15(6-8-16)18-13-17(26-23-18)14-22-19(25)20(9-1-2-10-20)24-11-3-4-12-24/h5-8,13H,1-4,9-12,14H2,(H,22,25)
InChIKeyLEAKEUDVJADAFU-UHFFFAOYSA-N
MW357.43 g/mol
LogP3.51
Rot. Bonds5

About N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide

N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide (PubChem CID 91836336) has the molecular formula C20H24FN3O2 and a molecular weight of 357.43 g/mol. Its IUPAC name is N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
PubChem CID91836336
Molecular FormulaC20H24FN3O2
Molecular Weight357.43 g/mol
Exact Mass357.19
IUPAC NameN-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
SMILESO=C(NCc1cc(-c2ccc(F)cc2)no1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C20H24FN3O2/c21-16-7-5-15(6-8-16)18-13-17(26-23-18)14-22-19(25)20(9-1-2-10-20)24-11-3-4-12-24/h5-8,13H,1-4,9-12,14H2,(H,22,25)
InChIKeyLEAKEUDVJADAFU-UHFFFAOYSA-N
XLogP3.51
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 118780237
N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 122556200
N-(1-benzofuran-2-ylmethyl)-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 131897762
N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-[(3R)-pyrrolidin-3-yl]acetamide
CID 125173596
N-[2-(4-fluorophenoxy)ethyl]-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 131930916
1-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]piperidine-4-carboxylic acid
CID 119906674
N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-piperidin-1-ylpropan-2-amine
CID 122564163
[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol
CID 22064141
(3aS,6aR)-2-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid;hydrochloride
CID 120680435
1-[4-(3,3-dimethylpiperidine-1-carbonyl)-4-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]piperidin-1-yl]ethanone
CID 155899906
5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
CID 90652941
(2,5-difluorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanone
CID 79058928

Frequently Asked Questions

What is the IUPAC name of N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The IUPAC name of N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide (CID 91836336) is N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The canonical SMILES for N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide is O=C(NCc1cc(-c2ccc(F)cc2)no1)C1(N2CCCC2)CCCC1.
What is the InChIKey of N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The InChIKey is LEAKEUDVJADAFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O2/c21-16-7-5-15(6-8-16)18-13-17(26-23-18)14-22-19(25)20(9-1-2-10-20)24-11-3-4-12-24/h5-8,13H,1-4,9-12,14H2,(H,22,25).
What are the key properties of N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide has a molecular weight of 357.43 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 91836336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).