4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide

C14H11ClF2N2O — CID 62297092

IUPAC4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1cc(F)cc(F)c1)c1cc(Cl)ccn1
InChIInChI=1S/C14H11ClF2N2O/c15-10-2-4-18-13(7-10)14(20)19-3-1-9-5-11(16)8-12(17)6-9/h2,4-8H,1,3H2,(H,19,20)
InChIKeyACDPDIPARSAXFF-UHFFFAOYSA-N
MW296.70 g/mol
LogP2.99
Rot. Bonds4

About 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide

4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide (PubChem CID 62297092) has the molecular formula C14H11ClF2N2O and a molecular weight of 296.70 g/mol. Its IUPAC name is 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide
PubChem CID62297092
Molecular FormulaC14H11ClF2N2O
Molecular Weight296.70 g/mol
Exact Mass296.05
IUPAC Name4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1cc(F)cc(F)c1)c1cc(Cl)ccn1
InChIInChI=1S/C14H11ClF2N2O/c15-10-2-4-18-13(7-10)14(20)19-3-1-9-5-11(16)8-12(17)6-9/h2,4-8H,1,3H2,(H,19,20)
InChIKeyACDPDIPARSAXFF-UHFFFAOYSA-N
XLogP2.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.70
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-[2-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 31799254
4-chloro-N-[2-(1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
CID 62186873
4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
CID 103743986
N-(3-aminopropyl)-4-chloropyridine-2-carboxamide
CID 61247982
4-[2-(3-chlorophenyl)ethylamino]-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109214119
N-[2-(4-fluorophenyl)ethyl]-4-[2-(4-fluorophenyl)ethylamino]pyridine-2-carboxamide
CID 109214099
4-chloro-N-[(2,5-difluorophenyl)methyl]pyridine-2-carboxamide
CID 63372919
2-N-[2-(4-chlorophenyl)ethyl]-4-N-(4-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109088541
4-chloro-N-hexylpyridine-2-carboxamide
CID 60656473
4-chloro-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 43088257
5-chloro-N-[2-(3,5-difluorophenyl)ethyl]furan-2-carboxamide
CID 113228849
4-chloro-N-[(3-chlorophenyl)methyl]pyridine-2-carboxamide
CID 9401789

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide (CID 62297092) is 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide is O=C(NCCc1cc(F)cc(F)c1)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is ACDPDIPARSAXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2N2O/c15-10-2-4-18-13(7-10)14(20)19-3-1-9-5-11(16)8-12(17)6-9/h2,4-8H,1,3H2,(H,19,20).
What are the key properties of 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide?
4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 296.70 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 62297092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).