N-[(1S)-1-phenylethyl]piperidine-2-carboxamide

C14H20N2O — CID 15445575

IUPACN-[(1S)-1-phenylethyl]piperidine-2-carboxamide
SMILESC[C@H](NC(=O)C1CCCCN1)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-11(12-7-3-2-4-8-12)16-14(17)13-9-5-6-10-15-13/h2-4,7-8,11,13,15H,5-6,9-10H2,1H3,(H,16,17)/t11-,13?/m0/s1
InChIKeyGSAXRBTWDKIQPP-AMGKYWFPSA-N
MW232.33 g/mol
LogP2.01
Rot. Bonds3

About N-[(1S)-1-phenylethyl]piperidine-2-carboxamide

N-[(1S)-1-phenylethyl]piperidine-2-carboxamide (PubChem CID 15445575) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[(1S)-1-phenylethyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-phenylethyl]piperidine-2-carboxamide
PubChem CID15445575
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[(1S)-1-phenylethyl]piperidine-2-carboxamide
SMILESC[C@H](NC(=O)C1CCCCN1)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-11(12-7-3-2-4-8-12)16-14(17)13-9-5-6-10-15-13/h2-4,7-8,11,13,15H,5-6,9-10H2,1H3,(H,16,17)/t11-,13?/m0/s1
InChIKeyGSAXRBTWDKIQPP-AMGKYWFPSA-N
XLogP2.01
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-phenylethyl]azepane-2-carboxamide
CID 78996687
N-(1-phenylethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261657
N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-2-carboxamide
CID 81355602
(2S)-N-[1-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 75495928
(2R)-N-[1-(4-bromophenyl)ethyl]piperidine-2-carboxamide
CID 103809894
N-[(1R)-1-pyridin-4-ylethyl]piperidine-2-carboxamide
CID 81410506
(2R)-N-[(1R)-1-(3-bromophenyl)ethyl]piperidine-2-carboxamide
CID 104914374
N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-2-carboxamide
CID 43705280
(2R)-N-[(1S)-1-(4-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 104914369
(2R)-N-(1-pyridin-3-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119998811
N-[(1R)-1-(3-bromophenyl)ethyl]azepane-2-carboxamide
CID 81375889
N-[(1R)-1-(3-fluorophenyl)ethyl]azepane-2-carboxamide
CID 81365964

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-phenylethyl]piperidine-2-carboxamide?
The IUPAC name of N-[(1S)-1-phenylethyl]piperidine-2-carboxamide (CID 15445575) is N-[(1S)-1-phenylethyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[(1S)-1-phenylethyl]piperidine-2-carboxamide?
The canonical SMILES for N-[(1S)-1-phenylethyl]piperidine-2-carboxamide is C[C@H](NC(=O)C1CCCCN1)c1ccccc1.
What is the InChIKey of N-[(1S)-1-phenylethyl]piperidine-2-carboxamide?
The InChIKey is GSAXRBTWDKIQPP-AMGKYWFPSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11(12-7-3-2-4-8-12)16-14(17)13-9-5-6-10-15-13/h2-4,7-8,11,13,15H,5-6,9-10H2,1H3,(H,16,17)/t11-,13?/m0/s1.
What are the key properties of N-[(1S)-1-phenylethyl]piperidine-2-carboxamide?
N-[(1S)-1-phenylethyl]piperidine-2-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-phenylethyl]piperidine-2-carboxamide is sourced from PubChem (CID 15445575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).