N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide

C16H20FNO — CID 110482201

IUPACN-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide
SMILESO=C(NC1(c2ccccc2F)CC1)C1CCCCC1
InChIInChI=1S/C16H20FNO/c17-14-9-5-4-8-13(14)16(10-11-16)18-15(19)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,18,19)
InChIKeyJUNLDNFJPPYURX-UHFFFAOYSA-N
MW261.34 g/mol
LogP3.51
Rot. Bonds3

About N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide

N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide (PubChem CID 110482201) has the molecular formula C16H20FNO and a molecular weight of 261.34 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide
PubChem CID110482201
Molecular FormulaC16H20FNO
Molecular Weight261.34 g/mol
Exact Mass261.15
IUPAC NameN-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide
SMILESO=C(NC1(c2ccccc2F)CC1)C1CCCCC1
InChIInChI=1S/C16H20FNO/c17-14-9-5-4-8-13(14)16(10-11-16)18-15(19)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,18,19)
InChIKeyJUNLDNFJPPYURX-UHFFFAOYSA-N
XLogP3.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-amino-N-[1-(2-fluorophenyl)cyclopropyl]cyclohexane-1-carboxamide;hydrochloride
CID 119796466
N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide
CID 110466283
N-[1-(2-fluorophenyl)cyclopentyl]-1-prop-2-enoylpiperidine-3-carboxamide
CID 166411319
1-cyclopropyl-3-[1-(2-fluorophenyl)cyclopropyl]urea
CID 110469627
N-[1-(2-fluorophenyl)cyclopropyl]propanamide
CID 110477459
(3S)-1-[2-(dimethylamino)ethyl]-N-[1-(2-fluorophenyl)cyclopropyl]-5-oxopyrrolidine-3-carboxamide
CID 95931367
N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide
CID 110445612
N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide
CID 110469855
N-[1-(2,3-difluorophenyl)cyclohexyl]-1-prop-2-enoylpiperidine-4-carboxamide
CID 166415999
2-fluoro-N-[1-(2-fluorophenyl)cyclopentyl]benzamide
CID 110444138
N-[1-(2-methylsulfonylphenyl)cyclopropyl]cyclopropanecarboxamide
CID 110478207
4-[[1-(2-fluorophenyl)cyclopropyl]amino]-4-oxobutanoic acid
CID 110465781

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide (CID 110482201) is N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide is O=C(NC1(c2ccccc2F)CC1)C1CCCCC1.
What is the InChIKey of N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide?
The InChIKey is JUNLDNFJPPYURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNO/c17-14-9-5-4-8-13(14)16(10-11-16)18-15(19)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,18,19).
What are the key properties of N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide?
N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide has a molecular weight of 261.34 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide is sourced from PubChem (CID 110482201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).