N-propylacetamide

C5H11NO — CID 21407

IUPACN-propylacetamide
SMILESCCCNC(C)=O
InChIInChI=1S/C5H11NO/c1-3-4-6-5(2)7/h3-4H2,1-2H3,(H,6,7)
InChIKeyIHPHPGLJYCDONF-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.53
Rot. Bonds2

About N-propylacetamide

N-propylacetamide (PubChem CID 21407) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is N-propylacetamide.

Molecular Properties

Compound NameN-propylacetamide
PubChem CID21407
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC NameN-propylacetamide
SMILESCCCNC(C)=O
InChIInChI=1S/C5H11NO/c1-3-4-6-5(2)7/h3-4H2,1-2H3,(H,6,7)
InChIKeyIHPHPGLJYCDONF-UHFFFAOYSA-N
XLogP0.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propylacetamide?
The IUPAC name of N-propylacetamide (CID 21407) is N-propylacetamide.
What is the SMILES notation for N-propylacetamide?
The canonical SMILES for N-propylacetamide is CCCNC(C)=O.
What is the InChIKey of N-propylacetamide?
The InChIKey is IHPHPGLJYCDONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-4-6-5(2)7/h3-4H2,1-2H3,(H,6,7).
What are the key properties of N-propylacetamide?
N-propylacetamide has a molecular weight of 101.15 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylacetamide is sourced from PubChem (CID 21407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).