N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide

C14H12F2N2O — CID 162399417

IUPACN-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide
SMILESO=C(NCC(F)(F)c1ccccc1)c1ccccn1
InChIInChI=1S/C14H12F2N2O/c15-14(16,11-6-2-1-3-7-11)10-18-13(19)12-8-4-5-9-17-12/h1-9H,10H2,(H,18,19)
InChIKeyDSYGARPIVCLAKC-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.60
Rot. Bonds4

About N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide

N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide (PubChem CID 162399417) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide
PubChem CID162399417
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC NameN-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide
SMILESO=C(NCC(F)(F)c1ccccc1)c1ccccn1
InChIInChI=1S/C14H12F2N2O/c15-14(16,11-6-2-1-3-7-11)10-18-13(19)12-8-4-5-9-17-12/h1-9H,10H2,(H,18,19)
InChIKeyDSYGARPIVCLAKC-UHFFFAOYSA-N
XLogP2.60
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2,2-dimethylpentyl)pyridine-2-carboxamide
CID 106144378
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243
N-methylpyridine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 172678259
N-phenacylpyridine-2-carboxamide
CID 64991609
N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-(2-bromoethyl)pyridine-2-carboxamide
CID 12983473
N-(1-hydroxy-2-phenylpropan-2-yl)pyridine-2-carboxamide
CID 105059023
N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
CID 139125511
N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
CID 139125512
2-(pyridine-2-carbonylamino)acetic acid;thiophene
CID 66951625
N-[2-(4-tert-butylphenyl)-2-hydroxyethyl]pyridine-2-carboxamide
CID 111422570
N-(2-hydroxy-2,5-dimethylhexyl)pyridine-2-carboxamide
CID 111485413

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide (CID 162399417) is N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide is O=C(NCC(F)(F)c1ccccc1)c1ccccn1.
What is the InChIKey of N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide?
The InChIKey is DSYGARPIVCLAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c15-14(16,11-6-2-1-3-7-11)10-18-13(19)12-8-4-5-9-17-12/h1-9H,10H2,(H,18,19).
What are the key properties of N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide?
N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide has a molecular weight of 262.26 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 162399417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).