N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide

C18H21N3O2 — CID 46384770

IUPACN-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C18H21N3O2/c1-23-17-5-3-2-4-16(17)20-18(22)14-8-12-21(13-9-14)15-6-10-19-11-7-15/h2-7,10-11,14H,8-9,12-13H2,1H3,(H,20,22)
InChIKeyJNYCCNCDPKBUMI-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.95
Rot. Bonds4

About N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide

N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide (PubChem CID 46384770) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
PubChem CID46384770
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC NameN-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C18H21N3O2/c1-23-17-5-3-2-4-16(17)20-18(22)14-8-12-21(13-9-14)15-6-10-19-11-7-15/h2-7,10-11,14H,8-9,12-13H2,1H3,(H,20,22)
InChIKeyJNYCCNCDPKBUMI-UHFFFAOYSA-N
XLogP2.95
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496
1-(2,2-dimethylpropanoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17224335
1-(2-fluorophenyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17152653
4-N-(2-methoxyphenyl)-1-N-(pyridin-4-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109148921
N-(5-chloro-2-methoxyphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152311
1-(1,3-benzoxazol-2-yl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17423416
N-(4-chloro-2,5-dimethoxyphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152391
N-(2-methoxyphenyl)-1-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 29133903
1-[1-(5-chloro-2-pyridinyl)piperidine-4-carbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 39466788
trans-(1R,2R)-2-[4-[(2-methoxyphenyl)carbamoyl]piperidine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 129468162
N-(2-methoxy-5-nitrophenyl)-1-phenylpiperidine-4-carboxamide
CID 17152327
4-N-(2-chlorophenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109150938

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide (CID 46384770) is N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide is COc1ccccc1NC(=O)C1CCN(c2ccncc2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide?
The InChIKey is JNYCCNCDPKBUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-23-17-5-3-2-4-16(17)20-18(22)14-8-12-21(13-9-14)15-6-10-19-11-7-15/h2-7,10-11,14H,8-9,12-13H2,1H3,(H,20,22).
What are the key properties of N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide?
N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide has a molecular weight of 311.38 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide is sourced from PubChem (CID 46384770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).