5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide

C14H11ClF2N2O2 — CID 90376725

IUPAC5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide
SMILESCOCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H11ClF2N2O2/c1-21-7-8-4-9(15)6-18-13(8)14(20)19-10-2-3-11(16)12(17)5-10/h2-6H,7H2,1H3,(H,19,20)
InChIKeyBUUZPWPCHFMOFO-UHFFFAOYSA-N
MW312.70 g/mol
LogP3.41
Rot. Bonds4

About 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide

5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide (PubChem CID 90376725) has the molecular formula C14H11ClF2N2O2 and a molecular weight of 312.70 g/mol. Its IUPAC name is 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide
PubChem CID90376725
Molecular FormulaC14H11ClF2N2O2
Molecular Weight312.70 g/mol
Exact Mass312.05
IUPAC Name5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide
SMILESCOCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H11ClF2N2O2/c1-21-7-8-4-9(15)6-18-13(8)14(20)19-10-2-3-11(16)12(17)5-10/h2-6H,7H2,1H3,(H,19,20)
InChIKeyBUUZPWPCHFMOFO-UHFFFAOYSA-N
XLogP3.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.70
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3R)-5-amino-3-(difluoromethyl)-2,6-dihydro-1,4-oxazin-3-yl]-4-fluorophenyl]-5-chloro-3-(methoxymethyl)pyridine-2-carboxamide
CID 70374609
N-(3,4-difluorophenyl)-4-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109206385
5-chloro-N-[4-fluoro-3-(hydroxymethyl)phenyl]pyridine-2-carboxamide
CID 90238140
N-(3,4-difluorophenyl)-2-(3-methoxypropylamino)pyrimidine-4-carboxamide
CID 109300152
5-(3,4-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109200977
5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
N-(3,4-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 62045147
N-(3,4-difluorophenyl)-2-(3-methoxypropylamino)pyridine-4-carboxamide
CID 109167317
2-(4-chloroanilino)-N-(3,4-difluorophenyl)pyrimidine-5-carboxamide
CID 109268923
N-(3,4-difluorophenyl)-6-ethoxypyridazine-3-carboxamide
CID 90509652
N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 2571943
N-[3-(5-amino-3,6,6-trimethyl-1,1-dioxo-2H-1,4-thiazin-3-yl)-4-fluorophenyl]-5-chloro-3-ethylpyridine-2-carboxamide
CID 123632880

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide?
The IUPAC name of 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide (CID 90376725) is 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide is COCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide?
The InChIKey is BUUZPWPCHFMOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2N2O2/c1-21-7-8-4-9(15)6-18-13(8)14(20)19-10-2-3-11(16)12(17)5-10/h2-6H,7H2,1H3,(H,19,20).
What are the key properties of 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide?
5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide has a molecular weight of 312.70 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3,4-difluorophenyl)-3-(methoxymethyl)pyridine-2-carboxamide is sourced from PubChem (CID 90376725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).