2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide

C13H15N3O2 — CID 4069560

IUPAC2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide
SMILESC=CCNC(=O)c1ccc(C(=O)NCC=C)nc1
InChIInChI=1S/C13H15N3O2/c1-3-7-14-12(17)10-5-6-11(16-9-10)13(18)15-8-4-2/h3-6,9H,1-2,7-8H2,(H,14,17)(H,15,18)
InChIKeyYIKVNPZXPLIVGM-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.91
Rot. Bonds6

About 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide

2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide (PubChem CID 4069560) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide
PubChem CID4069560
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide
SMILESC=CCNC(=O)c1ccc(C(=O)NCC=C)nc1
InChIInChI=1S/C13H15N3O2/c1-3-7-14-12(17)10-5-6-11(16-9-10)13(18)15-8-4-2/h3-6,9H,1-2,7-8H2,(H,14,17)(H,15,18)
InChIKeyYIKVNPZXPLIVGM-UHFFFAOYSA-N
XLogP0.91
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 6-(prop-2-enylcarbamoyl)pyridine-3-carboxylate
CID 31824869
6-phenyl-N-prop-2-enylpyridine-3-carboxamide
CID 110683620
N-prop-2-enyl-4-[4-(prop-2-enylcarbamoyl)phenyl]benzamide
CID 3714314
5-bromo-6-chloro-N-prop-2-enylpyridine-3-carboxamide
CID 130550467
5-(4-acetamidoanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180372
5-(4-methylanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180319
5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180232
5-(3,5-dichloroanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180409
6-(pentylamino)-N-prop-2-enylpyridine-3-carboxamide
CID 109151510
1-N,3-N,5-N-tris(prop-2-enyl)benzene-1,3,5-tricarboxamide
CID 54451991
4-(125I)iodo-N-prop-2-enyl(125I)benzamide
CID 118652264
6-[(2-hydroxy-3,3-dimethylbutyl)amino]-N-prop-2-enylpyridine-3-carboxamide
CID 133302745

Frequently Asked Questions

What is the IUPAC name of 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide (CID 4069560) is 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide is C=CCNC(=O)c1ccc(C(=O)NCC=C)nc1.
What is the InChIKey of 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide?
The InChIKey is YIKVNPZXPLIVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-3-7-14-12(17)10-5-6-11(16-9-10)13(18)15-8-4-2/h3-6,9H,1-2,7-8H2,(H,14,17)(H,15,18).
What are the key properties of 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide?
2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide has a molecular weight of 245.28 g/mol, XLogP of 0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide is sourced from PubChem (CID 4069560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).