2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide

C15H14F2N2O2 — CID 39561684

IUPAC2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide
SMILESO=C(NCCc1cccnc1)c1ccccc1OC(F)F
InChIInChI=1S/C15H14F2N2O2/c16-15(17)21-13-6-2-1-5-12(13)14(20)19-9-7-11-4-3-8-18-10-11/h1-6,8,10,15H,7,9H2,(H,19,20)
InChIKeyXHDLPDARCXVIFQ-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.66
Rot. Bonds6

About 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide

2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide (PubChem CID 39561684) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide
PubChem CID39561684
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide
SMILESO=C(NCCc1cccnc1)c1ccccc1OC(F)F
InChIInChI=1S/C15H14F2N2O2/c16-15(17)21-13-6-2-1-5-12(13)14(20)19-9-7-11-4-3-8-18-10-11/h1-6,8,10,15H,7,9H2,(H,19,20)
InChIKeyXHDLPDARCXVIFQ-UHFFFAOYSA-N
XLogP2.66
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide
CID 39559750
2-(difluoromethoxy)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide
CID 31002817
2-(difluoromethoxy)-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 39709098
2-(difluoromethoxy)-N-propylbenzamide
CID 60654909
N-benzyl-2-(difluoromethoxy)benzamide
CID 40548463
2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62072665
2-(difluoromethoxy)-N-ethylbenzamide
CID 60644731
2-anilino-N-(2-pyridin-3-ylethyl)benzamide
CID 36866409
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
2-(difluoromethoxy)-N-(3,3-diphenylpropyl)benzamide
CID 18225114
N-(4-bromobutyl)-2-(difluoromethoxy)benzamide
CID 106845934
2-(methylamino)-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62180569

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide?
The IUPAC name of 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide (CID 39561684) is 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide is O=C(NCCc1cccnc1)c1ccccc1OC(F)F.
What is the InChIKey of 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide?
The InChIKey is XHDLPDARCXVIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c16-15(17)21-13-6-2-1-5-12(13)14(20)19-9-7-11-4-3-8-18-10-11/h1-6,8,10,15H,7,9H2,(H,19,20).
What are the key properties of 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide?
2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide has a molecular weight of 292.29 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 39561684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).