5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide

C15H21N3O — CID 109224030

IUPAC5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide
SMILESC=CCNC(=O)c1cncc(N2CCCC(C)C2)c1
InChIInChI=1S/C15H21N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h3,8-10,12H,1,4-7,11H2,2H3,(H,17,19)
InChIKeyWJWVCYZYSKYUPR-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.23
Rot. Bonds4

About 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide

5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide (PubChem CID 109224030) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide
PubChem CID109224030
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide
SMILESC=CCNC(=O)c1cncc(N2CCCC(C)C2)c1
InChIInChI=1S/C15H21N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h3,8-10,12H,1,4-7,11H2,2H3,(H,17,19)
InChIKeyWJWVCYZYSKYUPR-UHFFFAOYSA-N
XLogP2.23
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide
CID 109222844
5-[(3S)-3-methylpiperidin-1-yl]pyridine-3-carboxylic acid
CID 126422492
5-(3-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229499
5-(4-ethylpiperazin-1-yl)-N-prop-2-enylpyridine-3-carboxamide
CID 109223965
methyl 4-[[5-(3-methylpiperidin-1-yl)pyridine-3-carbonyl]amino]benzoate
CID 109240867
5-[(1-methylpiperidin-3-yl)methyl]-N-prop-2-enylpyridine-3-carboxamide
CID 175653288
N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide
CID 109240823
N-prop-2-enyl-5-(4-pyridin-2-ylpiperazin-1-yl)pyridine-3-carboxamide
CID 109224016
(3-methylpiperidin-1-yl)-(5-piperidin-1-yl-3-pyridinyl)methanone
CID 109226519
methyl 4-chloro-3-[[5-(3-methylpiperidin-1-yl)pyridine-3-carbonyl]amino]benzoate
CID 109240868
4-[[(3S)-3-methylpiperidin-1-yl]methyl]-N-prop-2-enylbenzamide
CID 93490121
4-[(3-methylpiperidin-1-yl)methyl]-N-prop-2-enylbenzamide
CID 43918543

Frequently Asked Questions

What is the IUPAC name of 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide?
The IUPAC name of 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide (CID 109224030) is 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide.
What is the SMILES notation for 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide?
The canonical SMILES for 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide is C=CCNC(=O)c1cncc(N2CCCC(C)C2)c1.
What is the InChIKey of 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide?
The InChIKey is WJWVCYZYSKYUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h3,8-10,12H,1,4-7,11H2,2H3,(H,17,19).
What are the key properties of 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide?
5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide is sourced from PubChem (CID 109224030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).