N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide

C11H15N3O — CID 62142219

IUPACN-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
SMILESC=CCNc1ccnc(C(=O)NCC)c1
InChIInChI=1S/C11H15N3O/c1-3-6-13-9-5-7-14-10(8-9)11(15)12-4-2/h3,5,7-8H,1,4,6H2,2H3,(H,12,15)(H,13,14)
InChIKeyJIZJJSTXEAMNRZ-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.43
Rot. Bonds5

About N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide

N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide (PubChem CID 62142219) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
PubChem CID62142219
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
SMILESC=CCNc1ccnc(C(=O)NCC)c1
InChIInChI=1S/C11H15N3O/c1-3-6-13-9-5-7-14-10(8-9)11(15)12-4-2/h3,5,7-8H,1,4,6H2,2H3,(H,12,15)(H,13,14)
InChIKeyJIZJJSTXEAMNRZ-UHFFFAOYSA-N
XLogP1.43
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.43
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

N-pentyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 109202346
N-(2-phenylethyl)-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 109202307
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
N-butyl-N-methyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 109202347
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
4-(butan-2-ylamino)-N-prop-2-enylpyridine-2-carboxamide
CID 109202076
4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 43517863
N-ethyl-4-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-2-carboxamide
CID 79358278
N-(3,4-difluorophenyl)-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 109202462
4-[(4-amino-2,2-dimethylbutyl)amino]-N-ethylpyridine-2-carboxamide
CID 106142444
N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide
CID 115360776
N-(2-bromo-4-methylphenyl)-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 109202431

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide (CID 62142219) is N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide is C=CCNc1ccnc(C(=O)NCC)c1.
What is the InChIKey of N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide?
The InChIKey is JIZJJSTXEAMNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-3-6-13-9-5-7-14-10(8-9)11(15)12-4-2/h3,5,7-8H,1,4,6H2,2H3,(H,12,15)(H,13,14).
What are the key properties of N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide?
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62142219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).