N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide

C15H21FN2O — CID 104921807

IUPACN-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
SMILESCC1CCNC(C(=O)N[C@H](C)c2ccc(F)cc2)C1
InChIInChI=1S/C15H21FN2O/c1-10-7-8-17-14(9-10)15(19)18-11(2)12-3-5-13(16)6-4-12/h3-6,10-11,14,17H,7-9H2,1-2H3,(H,18,19)/t10?,11-,14?/m1/s1
InChIKeySTWQHJCKKVUKBP-IQLKVPPVSA-N
MW264.34 g/mol
LogP2.39
Rot. Bonds3

About N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide

N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide (PubChem CID 104921807) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
PubChem CID104921807
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
SMILESCC1CCNC(C(=O)N[C@H](C)c2ccc(F)cc2)C1
InChIInChI=1S/C15H21FN2O/c1-10-7-8-17-14(9-10)15(19)18-11(2)12-3-5-13(16)6-4-12/h3-6,10-11,14,17H,7-9H2,1-2H3,(H,18,19)/t10?,11-,14?/m1/s1
InChIKeySTWQHJCKKVUKBP-IQLKVPPVSA-N
XLogP2.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[1-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 75495928
N-[1-(3-chlorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423587
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81349681
(2R)-N-[(1R)-1-[4-(difluoromethyl)phenyl]ethyl]pyrrolidine-2-carboxamide
CID 175925248
N-(1-cyclopropylethyl)-4-methylpiperidine-2-carboxamide
CID 114422825
N-(2,2-dimethyl-1-phenylpropyl)-4-methylpiperidine-2-carboxamide
CID 114423032
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423858
N-[1-(1-benzofuran-2-yl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423092
3-[1-(4-fluorophenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63783147
4-ethyl-N-(1-phenylethyl)piperidine-2-carboxamide
CID 114427805
3-[(4-methylpiperidine-2-carbonyl)amino]-3-phenylpropanoic acid
CID 115867052
N-[1-(4-fluorophenyl)ethyl]cyclohexanecarboxamide
CID 46763137

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide (CID 104921807) is N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide is CC1CCNC(C(=O)N[C@H](C)c2ccc(F)cc2)C1.
What is the InChIKey of N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide?
The InChIKey is STWQHJCKKVUKBP-IQLKVPPVSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-10-7-8-17-14(9-10)15(19)18-11(2)12-3-5-13(16)6-4-12/h3-6,10-11,14,17H,7-9H2,1-2H3,(H,18,19)/t10?,11-,14?/m1/s1.
What are the key properties of N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide?
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide has a molecular weight of 264.34 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 104921807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).