4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide

C19H22F2N2O2 — CID 131892363

IUPAC4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide
SMILESCCCCC(c1cccnc1)N(C)C(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H22F2N2O2/c1-3-4-7-17(15-6-5-12-22-13-15)23(2)18(24)14-8-10-16(11-9-14)25-19(20)21/h5-6,8-13,17,19H,3-4,7H2,1-2H3
InChIKeyODSVHQAZVNTBBI-UHFFFAOYSA-N
MW348.39 g/mol
LogP4.69
Rot. Bonds8

About 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide

4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide (PubChem CID 131892363) has the molecular formula C19H22F2N2O2 and a molecular weight of 348.39 g/mol. Its IUPAC name is 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide.

Molecular Properties

Compound Name4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide
PubChem CID131892363
Molecular FormulaC19H22F2N2O2
Molecular Weight348.39 g/mol
Exact Mass348.16
IUPAC Name4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide
SMILESCCCCC(c1cccnc1)N(C)C(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H22F2N2O2/c1-3-4-7-17(15-6-5-12-22-13-15)23(2)18(24)14-8-10-16(11-9-14)25-19(20)21/h5-6,8-13,17,19H,3-4,7H2,1-2H3
InChIKeyODSVHQAZVNTBBI-UHFFFAOYSA-N
XLogP4.69
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.39
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-N,3-dimethyl-N-[(1R)-1-pyridin-3-ylpentyl]-1-benzofuran-2-carboxamide
CID 97113120
N,1,3-trimethyl-2,6-dioxo-N-[(1S)-1-pyridin-3-ylpentyl]pyrimidine-4-carboxamide
CID 95144359
3-(1,5-dimethyl-1,2,4-triazol-3-yl)-N-methyl-N-[(1R)-1-pyridin-3-ylpentyl]benzamide
CID 125156737
2-[4-(difluoromethoxy)phenoxy]-1-pyridin-3-ylpentan-1-one
CID 86157460
7-fluoro-N,2-dimethyl-N-[(1S)-1-pyridin-3-ylpentyl]quinoline-4-carboxamide
CID 96580826
3-[(2,5-difluorophenyl)methyl]-1-methyl-1-(1-pyridin-3-ylpentyl)urea
CID 119065675
N,3-dimethyl-4-[[methyl-[(1S)-1-pyridin-3-ylpentyl]carbamoyl]amino]benzamide
CID 125172275
N-methyl-N-[2-[methyl(1-pyridin-3-ylpentyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 131908751
6-chloro-N,1-dimethyl-N-[(1R)-1-pyridin-3-ylpentyl]indole-2-carboxamide
CID 99935099
1-methyl-3-(oxan-4-yl)-1-(1-pyridin-3-ylpentyl)urea
CID 119069380
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-1-methyl-1-[(1S)-1-pyridin-3-ylpentyl]urea
CID 97436636
1-methyl-3-[(6-oxo-1H-pyrimidin-4-yl)methyl]-1-[(1S)-1-pyridin-3-ylpentyl]urea
CID 137027898

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide?
The IUPAC name of 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide (CID 131892363) is 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide.
What is the SMILES notation for 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide?
The canonical SMILES for 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide is CCCCC(c1cccnc1)N(C)C(=O)c1ccc(OC(F)F)cc1.
What is the InChIKey of 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide?
The InChIKey is ODSVHQAZVNTBBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2N2O2/c1-3-4-7-17(15-6-5-12-22-13-15)23(2)18(24)14-8-10-16(11-9-14)25-19(20)21/h5-6,8-13,17,19H,3-4,7H2,1-2H3.
What are the key properties of 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide?
4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide has a molecular weight of 348.39 g/mol, XLogP of 4.69, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-N-methyl-N-(1-pyridin-3-ylpentyl)benzamide is sourced from PubChem (CID 131892363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).