4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide

C13H19N3O — CID 63327188

IUPAC4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccncc1NC(=O)C1(C)CCNCC1
InChIInChI=1S/C13H19N3O/c1-10-3-6-15-9-11(10)16-12(17)13(2)4-7-14-8-5-13/h3,6,9,14H,4-5,7-8H2,1-2H3,(H,16,17)
InChIKeyXMLMEXTWUXDTJN-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.72
Rot. Bonds2

About 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide

4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide (PubChem CID 63327188) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide
PubChem CID63327188
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccncc1NC(=O)C1(C)CCNCC1
InChIInChI=1S/C13H19N3O/c1-10-3-6-15-9-11(10)16-12(17)13(2)4-7-14-8-5-13/h3,6,9,14H,4-5,7-8H2,1-2H3,(H,16,17)
InChIKeyXMLMEXTWUXDTJN-UHFFFAOYSA-N
XLogP1.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Milrinone
CID 4197
Amrinone
CID 3698
3-Acetamidopyridine
CID 79978
N-cyclopropyl-1-(4-phenylpyridin-3-yl)piperidine-4-carboxamide
CID 118450420
(2S)-2-amino-1-piperidin-1-yl-4-(pyridin-4-ylmethylamino)butan-1-one
CID 11346439
(2E)-3-(4-tert-butylphenyl)-N-(pyridin-3-yl)prop-2-enamide
CID 749825
(2E)-3-phenyl-N-(pyridin-3-yl)prop-2-enamide
CID 825474
N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
CID 1247370
Ethanediamide, N,N'-bis(4-pyridinylmethyl)-
CID 3121386
2-phenyl-N-pyridin-3-ylbutanamide
CID 4047159
1-phenyl-N-3-pyridinylcyclopentanecarboxamide
CID 744343
3-phenyl-N-pyridin-3-ylpropanamide
CID 683950

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide (CID 63327188) is 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide is Cc1ccncc1NC(=O)C1(C)CCNCC1.
What is the InChIKey of 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide?
The InChIKey is XMLMEXTWUXDTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10-3-6-15-9-11(10)16-12(17)13(2)4-7-14-8-5-13/h3,6,9,14H,4-5,7-8H2,1-2H3,(H,16,17).
What are the key properties of 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide?
4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methyl-3-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 63327188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).