(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide

C12H14ClFN2O — CID 28969312

IUPAC(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1F)[C@H]1CCCCN1
InChIInChI=1S/C12H14ClFN2O/c13-8-4-3-6-9(11(8)14)16-12(17)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H,16,17)/t10-/m1/s1
InChIKeyKYRXDFDVTWXCGL-SNVBAGLBSA-N
MW256.71 g/mol
LogP2.56
Rot. Bonds2

About (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide

(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide (PubChem CID 28969312) has the molecular formula C12H14ClFN2O and a molecular weight of 256.71 g/mol. Its IUPAC name is (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide
PubChem CID28969312
Molecular FormulaC12H14ClFN2O
Molecular Weight256.71 g/mol
Exact Mass256.08
IUPAC Name(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1F)[C@H]1CCCCN1
InChIInChI=1S/C12H14ClFN2O/c13-8-4-3-6-9(11(8)14)16-12(17)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H,16,17)/t10-/m1/s1
InChIKeyKYRXDFDVTWXCGL-SNVBAGLBSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.71
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 64563193
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(2S)-N-[3-chloro-2-(dimethylamino)phenyl]piperidine-2-carboxamide
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N-(2-fluorophenyl)piperidine-2-carboxamide;hydrochloride
CID 119262310
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CID 28969320
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CID 66470974
(2R)-N-(2-hydroxyphenyl)piperidine-2-carboxamide
CID 104694666
(2S)-N-[3-chloro-2-(dimethylamino)phenyl]pyrrolidine-2-carboxamide
CID 61154948
(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 28951007
(2S)-N-[3-chloro-2-(1,2,4-triazol-1-yl)phenyl]piperidine-2-carboxamide
CID 104913077
N-(2-bromophenyl)piperidine-2-carboxamide
CID 18071832
N-(3-chloro-2-fluorophenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76892616

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide?
The IUPAC name of (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide (CID 28969312) is (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide is O=C(Nc1cccc(Cl)c1F)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide?
The InChIKey is KYRXDFDVTWXCGL-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H14ClFN2O/c13-8-4-3-6-9(11(8)14)16-12(17)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H,16,17)/t10-/m1/s1.
What are the key properties of (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide?
(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide has a molecular weight of 256.71 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide is sourced from PubChem (CID 28969312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).