nonadec-3-enamide

C19H37NO — CID 54215031

IUPACnonadec-3-enamide
SMILESCCCCCCCCCCCCCCCC=CCC(N)=O
InChIInChI=1S/C19H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h16-17H,2-15,18H2,1H3,(H2,20,21)
InChIKeyPYOMSLDGQIPONT-UHFFFAOYSA-N
MW295.51 g/mol
LogP5.90
Rot. Bonds16

About nonadec-3-enamide

nonadec-3-enamide (PubChem CID 54215031) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is nonadec-3-enamide.

Molecular Properties

Compound Namenonadec-3-enamide
PubChem CID54215031
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC Namenonadec-3-enamide
SMILESCCCCCCCCCCCCCCCC=CCC(N)=O
InChIInChI=1S/C19H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h16-17H,2-15,18H2,1H3,(H2,20,21)
InChIKeyPYOMSLDGQIPONT-UHFFFAOYSA-N
XLogP5.90
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.51
LogP ≤ 55.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

octadec-9-enamide
CID 75990485
(Z)-tetratriacont-9-enamide
CID 86624387
(E)-icos-11-enamide
CID 5365373
octadec-8-enamide
CID 57212690
(Z)-tricos-15-enamide
CID 155109212
(Z)-(113C)octadec-9-enamide
CID 175811454
(Z)-octadec-9-enamide;platinum
CID 174872668
(Z)-octadec-9-enamide;hydrobromide
CID 146504042
indigane;(Z)-octadec-9-enamide
CID 174921402
azane;butanediamide;tetradec-3-enoic acid
CID 174984543
ethanamine;(Z)-octadec-9-enamide
CID 174881781
mercury;(Z)-octadec-9-enamide;hydrochloride
CID 175499195

Frequently Asked Questions

What is the IUPAC name of nonadec-3-enamide?
The IUPAC name of nonadec-3-enamide (CID 54215031) is nonadec-3-enamide.
What is the SMILES notation for nonadec-3-enamide?
The canonical SMILES for nonadec-3-enamide is CCCCCCCCCCCCCCCC=CCC(N)=O.
What is the InChIKey of nonadec-3-enamide?
The InChIKey is PYOMSLDGQIPONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h16-17H,2-15,18H2,1H3,(H2,20,21).
What are the key properties of nonadec-3-enamide?
nonadec-3-enamide has a molecular weight of 295.51 g/mol, XLogP of 5.90, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for nonadec-3-enamide is sourced from PubChem (CID 54215031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).