N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide

C23H31N3O2 — CID 42852151

IUPACN-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2CCCCC2)c(C2CCN(Cc3ccco3)CC2)n1
InChIInChI=1S/C23H31N3O2/c1-17-9-10-21(23(27)25-19-6-3-2-4-7-19)22(24-17)18-11-13-26(14-12-18)16-20-8-5-15-28-20/h5,8-10,15,18-19H,2-4,6-7,11-14,16H2,1H3,(H,25,27)
InChIKeyZUDJXRLDKIKJAG-UHFFFAOYSA-N
MW381.52 g/mol
LogP4.43
Rot. Bonds5

About N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide

N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide (PubChem CID 42852151) has the molecular formula C23H31N3O2 and a molecular weight of 381.52 g/mol. Its IUPAC name is N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide
PubChem CID42852151
Molecular FormulaC23H31N3O2
Molecular Weight381.52 g/mol
Exact Mass381.24
IUPAC NameN-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2CCCCC2)c(C2CCN(Cc3ccco3)CC2)n1
InChIInChI=1S/C23H31N3O2/c1-17-9-10-21(23(27)25-19-6-3-2-4-7-19)22(24-17)18-11-13-26(14-12-18)16-20-8-5-15-28-20/h5,8-10,15,18-19H,2-4,6-7,11-14,16H2,1H3,(H,25,27)
InChIKeyZUDJXRLDKIKJAG-UHFFFAOYSA-N
XLogP4.43
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(furan-2-carbonyl)piperidin-4-yl]-6-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 42867138
N-[1-(furan-2-ylmethyl)piperidin-4-yl]-2-(methylamino)pyridine-4-carboxamide
CID 77093957
2-[1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)acetyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide
CID 3741217
2-[1-[2-(furan-2-carbonylamino)acetyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide
CID 3728266
N-(cyclohexylmethyl)-2-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-6-methylpyridine-3-carboxamide
CID 46069178
(3R)-N-[1-(furan-2-ylmethyl)piperidin-4-yl]-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
CID 125439338
2-[1-[4-(2,2-dimethylhydrazinyl)-4-oxobutanoyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide
CID 3350598
N-cyclohexyl-N,6-dimethyl-2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 46044896
2-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-6-methyl-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 46069186
N-[(2-methoxyphenyl)methyl]-2-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-6-methylpyridine-3-carboxamide
CID 83287729
2-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]-6-methyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 42868248
N-[2-(4,6-dimethylpyrimidin-2-yl)ethyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 91775679

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide (CID 42852151) is N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)NC2CCCCC2)c(C2CCN(Cc3ccco3)CC2)n1.
What is the InChIKey of N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide?
The InChIKey is ZUDJXRLDKIKJAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O2/c1-17-9-10-21(23(27)25-19-6-3-2-4-7-19)22(24-17)18-11-13-26(14-12-18)16-20-8-5-15-28-20/h5,8-10,15,18-19H,2-4,6-7,11-14,16H2,1H3,(H,25,27).
What are the key properties of N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide?
N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide has a molecular weight of 381.52 g/mol, XLogP of 4.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[1-(furan-2-ylmethyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 42852151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).