4-amino-N-propylpent-4-enamide

C8H16N2O — CID 138463732

IUPAC4-amino-N-propylpent-4-enamide
SMILESC=C(N)CCC(=O)NCCC
InChIInChI=1S/C8H16N2O/c1-3-6-10-8(11)5-4-7(2)9/h2-6,9H2,1H3,(H,10,11)
InChIKeyYPWPLGYQOPIFSS-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.77
Rot. Bonds5

About 4-amino-N-propylpent-4-enamide

4-amino-N-propylpent-4-enamide (PubChem CID 138463732) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 4-amino-N-propylpent-4-enamide.

Molecular Properties

Compound Name4-amino-N-propylpent-4-enamide
PubChem CID138463732
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name4-amino-N-propylpent-4-enamide
SMILESC=C(N)CCC(=O)NCCC
InChIInChI=1S/C8H16N2O/c1-3-6-10-8(11)5-4-7(2)9/h2-6,9H2,1H3,(H,10,11)
InChIKeyYPWPLGYQOPIFSS-UHFFFAOYSA-N
XLogP0.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-propylpent-4-enamide?
The IUPAC name of 4-amino-N-propylpent-4-enamide (CID 138463732) is 4-amino-N-propylpent-4-enamide.
What is the SMILES notation for 4-amino-N-propylpent-4-enamide?
The canonical SMILES for 4-amino-N-propylpent-4-enamide is C=C(N)CCC(=O)NCCC.
What is the InChIKey of 4-amino-N-propylpent-4-enamide?
The InChIKey is YPWPLGYQOPIFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-3-6-10-8(11)5-4-7(2)9/h2-6,9H2,1H3,(H,10,11).
What are the key properties of 4-amino-N-propylpent-4-enamide?
4-amino-N-propylpent-4-enamide has a molecular weight of 156.23 g/mol, XLogP of 0.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-propylpent-4-enamide is sourced from PubChem (CID 138463732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).