3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide

C14H18FN3O2 — CID 47258071

IUPAC3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide
SMILESCC(=O)NC1CCCN(C(=O)Nc2ccccc2F)C1
InChIInChI=1S/C14H18FN3O2/c1-10(19)16-11-5-4-8-18(9-11)14(20)17-13-7-3-2-6-12(13)15/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,16,19)(H,17,20)
InChIKeyCWXDCJVQKMQXOU-UHFFFAOYSA-N
MW279.31 g/mol
LogP1.96
Rot. Bonds2

About 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide

3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide (PubChem CID 47258071) has the molecular formula C14H18FN3O2 and a molecular weight of 279.31 g/mol. Its IUPAC name is 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide
PubChem CID47258071
Molecular FormulaC14H18FN3O2
Molecular Weight279.31 g/mol
Exact Mass279.14
IUPAC Name3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide
SMILESCC(=O)NC1CCCN(C(=O)Nc2ccccc2F)C1
InChIInChI=1S/C14H18FN3O2/c1-10(19)16-11-5-4-8-18(9-11)14(20)17-13-7-3-2-6-12(13)15/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,16,19)(H,17,20)
InChIKeyCWXDCJVQKMQXOU-UHFFFAOYSA-N
XLogP1.96
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-(2-fluorophenyl)-3-methylpiperidine-1-carboxamide
CID 41097666
(3S)-3-acetamido-N-(2-fluoro-4-propan-2-yloxyphenyl)piperidine-1-carboxamide
CID 95322997
(3S)-3-acetamido-N-(3,4-difluorophenyl)piperidine-1-carboxamide
CID 96559490
(3R)-1-[(2-fluorophenyl)carbamoyl]piperidine-3-carboxylic acid
CID 28512627
3-N-(2-aminophenyl)-1-N-(2-fluorophenyl)piperidine-1,3-dicarboxamide;hydrochloride
CID 119422157
N-(2-fluorophenyl)-3-hydroxypyrrolidine-1-carboxamide
CID 62917965
N-(2-fluorophenyl)-3-(N'-hydroxycarbamimidoyl)piperidine-1-carboxamide
CID 77041701
N-(2-fluorophenyl)-3-pyrimidin-2-yloxypiperidine-1-carboxamide
CID 122257527
(3R)-N-(2-fluorophenyl)-3-(methanesulfonamidomethyl)piperidine-1-carboxamide
CID 94139041
(3R,4S)-N-(2-fluorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79410579
(3R)-3-(methylamino)-N-(2-methylphenyl)piperidine-1-carboxamide;hydrochloride
CID 172646427
N-[1-(3,4-difluorobenzoyl)piperidin-3-yl]acetamide
CID 47250997

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide?
The IUPAC name of 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide (CID 47258071) is 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide?
The canonical SMILES for 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide is CC(=O)NC1CCCN(C(=O)Nc2ccccc2F)C1.
What is the InChIKey of 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide?
The InChIKey is CWXDCJVQKMQXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O2/c1-10(19)16-11-5-4-8-18(9-11)14(20)17-13-7-3-2-6-12(13)15/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,16,19)(H,17,20).
What are the key properties of 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide?
3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide has a molecular weight of 279.31 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(2-fluorophenyl)piperidine-1-carboxamide is sourced from PubChem (CID 47258071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).