1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide

C14H19FN2O — CID 43918336

IUPAC1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O/c1-16-14(18)12-6-4-8-17(10-12)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18)
InChIKeySYTQUKKVDBQWQQ-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.78
Rot. Bonds3

About 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide

1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide (PubChem CID 43918336) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide
PubChem CID43918336
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O/c1-16-14(18)12-6-4-8-17(10-12)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18)
InChIKeySYTQUKKVDBQWQQ-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-ethylphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 136534264
1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide
CID 103196911
N-tert-butyl-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43918466
1-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]ethanone
CID 63846661
1-[(2-fluorophenyl)methyl]-N-pentan-2-ylpiperidine-3-carboxamide
CID 43924676
N-benzhydryl-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43925897
1-benzyl-N-methylpiperidine-3-carboxamide
CID 43918327
azepan-1-yl-[(3R)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]methanone
CID 756318
1-[(2-fluorophenyl)methyl]-N-naphthalen-1-ylpiperidine-3-carboxamide
CID 43919580
N-(3-ethoxypropyl)-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43923972
1-[(2-fluorophenyl)methyl]-N-methyl-4-(oxan-4-yl)-1,4-diazepane-6-carboxamide
CID 127245395
N-(2-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43919730

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide (CID 43918336) is 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(Cc2ccccc2F)C1.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide?
The InChIKey is SYTQUKKVDBQWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-16-14(18)12-6-4-8-17(10-12)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18).
What are the key properties of 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide?
1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide has a molecular weight of 250.32 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 43918336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).