2-amino-N-propylacetamide

C5H12N2O — CID 4961985

IUPAC2-amino-N-propylacetamide
SMILESCCCNC(=O)CN
InChIInChI=1S/C5H12N2O/c1-2-3-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8)
InChIKeyFDYLEQIJNGFKPH-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.53
Rot. Bonds3

About 2-amino-N-propylacetamide

2-amino-N-propylacetamide (PubChem CID 4961985) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is 2-amino-N-propylacetamide.

Molecular Properties

Compound Name2-amino-N-propylacetamide
PubChem CID4961985
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name2-amino-N-propylacetamide
SMILESCCCNC(=O)CN
InChIInChI=1S/C5H12N2O/c1-2-3-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8)
InChIKeyFDYLEQIJNGFKPH-UHFFFAOYSA-N
XLogP-0.53
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propylacetamide?
The IUPAC name of 2-amino-N-propylacetamide (CID 4961985) is 2-amino-N-propylacetamide.
What is the SMILES notation for 2-amino-N-propylacetamide?
The canonical SMILES for 2-amino-N-propylacetamide is CCCNC(=O)CN.
What is the InChIKey of 2-amino-N-propylacetamide?
The InChIKey is FDYLEQIJNGFKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-2-3-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8).
What are the key properties of 2-amino-N-propylacetamide?
2-amino-N-propylacetamide has a molecular weight of 116.16 g/mol, XLogP of -0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propylacetamide is sourced from PubChem (CID 4961985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).