1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide

C13H18N4O3 — CID 47222931

IUPAC1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide
SMILESCOc1ncccc1NC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C13H18N4O3/c1-20-12-10(3-2-6-15-12)16-13(19)17-7-4-9(5-8-17)11(14)18/h2-3,6,9H,4-5,7-8H2,1H3,(H2,14,18)(H,16,19)
InChIKeyQGBAYWGBPWTWGD-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.82
Rot. Bonds3

About 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide

1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide (PubChem CID 47222931) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide
PubChem CID47222931
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Name1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide
SMILESCOc1ncccc1NC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C13H18N4O3/c1-20-12-10(3-2-6-15-12)16-13(19)17-7-4-9(5-8-17)11(14)18/h2-3,6,9H,4-5,7-8H2,1H3,(H2,14,18)(H,16,19)
InChIKeyQGBAYWGBPWTWGD-UHFFFAOYSA-N
XLogP0.82
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-3-pyridinyl)-3-methylpiperidine-1-carboxamide
CID 47042573
(3S)-1-N-(2-piperidin-1-yl-3-pyridinyl)pyrrolidine-1,3-dicarboxamide
CID 95580121
(3S)-N-(2-methoxy-3-pyridinyl)-3-[[methyl(propyl)amino]methyl]pyrrolidine-1-carboxamide
CID 95783484
1-N-(2,5-dimethoxyphenyl)piperidine-1,4-dicarboxamide
CID 3830798
4-(3-chlorophenyl)-N-(2-methoxy-3-pyridinyl)piperazine-1-carboxamide
CID 18663039
1-(2-methoxy-3-pyridinyl)-3-pyrrolidin-1-ylurea
CID 100763708
4-[2-(diethylamino)-2-oxoethyl]-N-(2-methoxy-3-pyridinyl)piperazine-1-carboxamide
CID 56817760
1-[(8-methoxyquinolin-5-yl)carbamoyl]piperidine-4-carboxylic acid
CID 122078081
(3S)-1-[(2-methoxy-3-pyridinyl)sulfamoyl]piperidine-3-carboxamide
CID 172908581
N-[[(1R,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-N'-(2-methoxy-3-pyridinyl)oxamide
CID 125319980
4-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)piperidine-1-carboxamide
CID 47041032
(2R)-N-(2-methoxy-3-pyridinyl)-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 124603422

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide (CID 47222931) is 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide is COc1ncccc1NC(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide?
The InChIKey is QGBAYWGBPWTWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c1-20-12-10(3-2-6-15-12)16-13(19)17-7-4-9(5-8-17)11(14)18/h2-3,6,9H,4-5,7-8H2,1H3,(H2,14,18)(H,16,19).
What are the key properties of 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide?
1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide has a molecular weight of 278.31 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 47222931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).