N-prop-2-enyl-3-pyridin-3-ylpropanamide

C11H14N2O — CID 60667734

IUPACN-prop-2-enyl-3-pyridin-3-ylpropanamide
SMILESC=CCNC(=O)CCc1cccnc1
InChIInChI=1S/C11H14N2O/c1-2-7-13-11(14)6-5-10-4-3-8-12-9-10/h2-4,8-9H,1,5-7H2,(H,13,14)
InChIKeyVXJGLPQMYNNKLN-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.32
Rot. Bonds5

About N-prop-2-enyl-3-pyridin-3-ylpropanamide

N-prop-2-enyl-3-pyridin-3-ylpropanamide (PubChem CID 60667734) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-prop-2-enyl-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-prop-2-enyl-3-pyridin-3-ylpropanamide
PubChem CID60667734
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-prop-2-enyl-3-pyridin-3-ylpropanamide
SMILESC=CCNC(=O)CCc1cccnc1
InChIInChI=1S/C11H14N2O/c1-2-7-13-11(14)6-5-10-4-3-8-12-9-10/h2-4,8-9H,1,5-7H2,(H,13,14)
InChIKeyVXJGLPQMYNNKLN-UHFFFAOYSA-N
XLogP1.32
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-prop-2-enyl-3-pyridin-4-ylpropanamide
CID 110468372
N-(2-ethylbutyl)-3-pyridin-3-ylpropanamide
CID 115612776
N-(2-methylprop-1-enyl)-3-pyridin-3-ylpropanamide
CID 177435209
N-(3,3-difluoro-2-hydroxypropyl)-3-pyridin-3-ylpropanamide
CID 103769874
N-(2-phenylethyl)-4-pyridin-3-ylbutanamide
CID 110410890
N-(4-iodophenyl)-3-pyridin-3-ylpropanamide
CID 9206675
(2S)-2-hydroxy-4-(3-pyridin-3-ylpropanoylamino)butanoic acid
CID 107834523
N-prop-2-enyl-4-(2-pyridin-3-ylethylcarbamoylamino)benzamide
CID 87010679
N-[(E)-but-2-enyl]-2-pyridin-3-ylacetamide
CID 178011059
2-N-prop-2-enyl-6-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109094037
N-[3-(dimethylamino)propyl]-4-pyridin-3-ylbutanamide
CID 110408294
N-(4-hydroxy-2,2-dimethylbutyl)-3-pyridin-3-ylpropanamide
CID 103772608

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-3-pyridin-3-ylpropanamide?
The IUPAC name of N-prop-2-enyl-3-pyridin-3-ylpropanamide (CID 60667734) is N-prop-2-enyl-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-prop-2-enyl-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-prop-2-enyl-3-pyridin-3-ylpropanamide is C=CCNC(=O)CCc1cccnc1.
What is the InChIKey of N-prop-2-enyl-3-pyridin-3-ylpropanamide?
The InChIKey is VXJGLPQMYNNKLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-2-7-13-11(14)6-5-10-4-3-8-12-9-10/h2-4,8-9H,1,5-7H2,(H,13,14).
What are the key properties of N-prop-2-enyl-3-pyridin-3-ylpropanamide?
N-prop-2-enyl-3-pyridin-3-ylpropanamide has a molecular weight of 190.25 g/mol, XLogP of 1.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 60667734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).