N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide

C21H25FN2O2 — CID 162655994

IUPACN-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2CCCCCC2)c(OCc2ccc(F)cc2)n1
InChIInChI=1S/C21H25FN2O2/c1-15-8-13-19(20(25)24-18-6-4-2-3-5-7-18)21(23-15)26-14-16-9-11-17(22)12-10-16/h8-13,18H,2-7,14H2,1H3,(H,24,25)
InChIKeyNRGJIFHBRFCUIQ-UHFFFAOYSA-N
MW356.44 g/mol
LogP4.56
Rot. Bonds5

About N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide

N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide (PubChem CID 162655994) has the molecular formula C21H25FN2O2 and a molecular weight of 356.44 g/mol. Its IUPAC name is N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide
PubChem CID162655994
Molecular FormulaC21H25FN2O2
Molecular Weight356.44 g/mol
Exact Mass356.19
IUPAC NameN-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2CCCCCC2)c(OCc2ccc(F)cc2)n1
InChIInChI=1S/C21H25FN2O2/c1-15-8-13-19(20(25)24-18-6-4-2-3-5-7-18)21(23-15)26-14-16-9-11-17(22)12-10-16/h8-13,18H,2-7,14H2,1H3,(H,24,25)
InChIKeyNRGJIFHBRFCUIQ-UHFFFAOYSA-N
XLogP4.56
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.44
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

VU0404251
CID 58368068
2-ethoxy-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 1478065
2-ethoxy-N-[(2-fluorophenyl)methyl]pyridine-3-carboxamide
CID 2080643
2-ethoxy-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 2096181
2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 9113215
2-(4-Fluoro-phenoxy)-N-(4-methoxy-benzyl)-nicotinamide
CID 9884857
2-(4-fluorophenoxy)-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 14555282
N-cyclohexyl-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 51036707
2-((3-fluorobenzyl)oxy)-7,8-dihydro-1,6-naphthyridin-5(6H)-one
CID 57405264
N-[(1S)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368063
N-[(1S)-1-Cyclopropyl-2,2,2-trifluoroethyl]-6-[(3-fluorophenyl)methoxy]-3-pyridinecarboxamide
CID 58368069

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide (CID 162655994) is N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)NC2CCCCCC2)c(OCc2ccc(F)cc2)n1.
What is the InChIKey of N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide?
The InChIKey is NRGJIFHBRFCUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O2/c1-15-8-13-19(20(25)24-18-6-4-2-3-5-7-18)21(23-15)26-14-16-9-11-17(22)12-10-16/h8-13,18H,2-7,14H2,1H3,(H,24,25).
What are the key properties of N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide?
N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide has a molecular weight of 356.44 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[(4-fluorophenyl)methoxy]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 162655994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).