1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

C19H20N4O2 — CID 17438163

IUPAC1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(c3ccc(C#N)cn3)CC2)c1
InChIInChI=1S/C19H20N4O2/c1-25-17-4-2-3-16(11-17)22-19(24)15-7-9-23(10-8-15)18-6-5-14(12-20)13-21-18/h2-6,11,13,15H,7-10H2,1H3,(H,22,24)
InChIKeyCZDYCBMJSFRUIJ-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.82
Rot. Bonds4

About 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide (PubChem CID 17438163) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
PubChem CID17438163
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(c3ccc(C#N)cn3)CC2)c1
InChIInChI=1S/C19H20N4O2/c1-25-17-4-2-3-16(11-17)22-19(24)15-7-9-23(10-8-15)18-6-5-14(12-20)13-21-18/h2-6,11,13,15H,7-10H2,1H3,(H,22,24)
InChIKeyCZDYCBMJSFRUIJ-UHFFFAOYSA-N
XLogP2.82
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-cyano-2-pyridinyl)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]piperidine-4-carboxamide
CID 46432232
1-(5-cyano-2-pyridinyl)-N-(3-methylphenyl)piperidine-4-carboxamide
CID 16588037
1-(5-cyano-2-pyridinyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 16588046
N-(3-bromophenyl)-1-(5-cyano-2-pyridinyl)piperidine-4-carboxamide
CID 16588035
1-(5-cyano-2-pyridinyl)-N-[3-(cyclopropylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 46699660
1-(5-cyano-2-pyridinyl)-N-[3-(furan-2-carbonylamino)phenyl]piperidine-4-carboxamide
CID 46509482
N-(3-methoxyphenyl)-1-quinoxalin-2-ylpiperidine-4-carboxamide
CID 16875982
1-(5-cyano-2-pyridinyl)-N-methylpiperidine-4-carboxamide
CID 47135971
N-(3-methoxyphenyl)-1-[6-(4-methylphenyl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 53062144
1-(5-cyano-2-pyridinyl)-N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 16594024
1-(5-cyano-2-pyridinyl)-N-(2-methylphenyl)piperidine-4-carboxamide
CID 17443908
N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyano-2-pyridinyl)piperidine-4-carboxamide
CID 30135877

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide (CID 17438163) is 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide is COc1cccc(NC(=O)C2CCN(c3ccc(C#N)cn3)CC2)c1.
What is the InChIKey of 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The InChIKey is CZDYCBMJSFRUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-17-4-2-3-16(11-17)22-19(24)15-7-9-23(10-8-15)18-6-5-14(12-20)13-21-18/h2-6,11,13,15H,7-10H2,1H3,(H,22,24).
What are the key properties of 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyano-2-pyridinyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17438163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).