N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide

C13H16FNO2 — CID 110907192

IUPACN-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCc1cccc(F)c1)C1(O)CCCC1
InChIInChI=1S/C13H16FNO2/c14-11-5-3-4-10(8-11)9-15-12(16)13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16)
InChIKeyYOANLVFTQSOZHG-UHFFFAOYSA-N
MW237.27 g/mol
LogP1.75
Rot. Bonds3

About N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide

N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide (PubChem CID 110907192) has the molecular formula C13H16FNO2 and a molecular weight of 237.27 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide
PubChem CID110907192
Molecular FormulaC13H16FNO2
Molecular Weight237.27 g/mol
Exact Mass237.12
IUPAC NameN-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCc1cccc(F)c1)C1(O)CCCC1
InChIInChI=1S/C13H16FNO2/c14-11-5-3-4-10(8-11)9-15-12(16)13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16)
InChIKeyYOANLVFTQSOZHG-UHFFFAOYSA-N
XLogP1.75
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-hydroxy-N-[(3-methylphenyl)methyl]cyclopentane-1-carboxamide
CID 110907173
2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide
CID 64683966
methyl 1-[(3-fluorophenyl)methylcarbamoyl]cyclopropane-1-carboxylate
CID 115184452
1-cyano-N-[(3-fluorophenyl)methyl]cyclopropane-1-carboxamide
CID 80598717
2-[1-[(3-fluorophenyl)methylcarbamoylamino]cyclopentyl]acetic acid
CID 64701035
1-hydroxy-N-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]cyclopentane-1-carboxamide
CID 110922178
N-[(3-fluorophenyl)methyl]-1-(N'-hydroxycarbamimidoyl)cyclohexane-1-carboxamide
CID 76919450
1-carbamothioyl-N-[(3-fluorophenyl)methyl]cyclopropane-1-carboxamide
CID 80592746
3-ethyl-N-[(3-fluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 55165134
2,2-dichloro-N-[(3-fluorophenyl)methyl]-1-methylcyclopropane-1-carboxamide
CID 46447833
4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide
CID 63127725
2-amino-N-[(3-fluorophenyl)methyl]-1-methylcyclopentane-1-carboxamide
CID 82763607

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide (CID 110907192) is N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide is O=C(NCc1cccc(F)c1)C1(O)CCCC1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide?
The InChIKey is YOANLVFTQSOZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FNO2/c14-11-5-3-4-10(8-11)9-15-12(16)13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16).
What are the key properties of N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide?
N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide has a molecular weight of 237.27 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110907192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).