N-(2-aminoethyl)propanamide

C5H12N2O — CID 4551317

IUPACN-(2-aminoethyl)propanamide
SMILESCCC(=O)NCCN
InChIInChI=1S/C5H12N2O/c1-2-5(8)7-4-3-6/h2-4,6H2,1H3,(H,7,8)
InChIKeySUYTZMWLZYCZEF-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.53
Rot. Bonds3

About N-(2-aminoethyl)propanamide

N-(2-aminoethyl)propanamide (PubChem CID 4551317) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is N-(2-aminoethyl)propanamide.

Molecular Properties

Compound NameN-(2-aminoethyl)propanamide
PubChem CID4551317
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameN-(2-aminoethyl)propanamide
SMILESCCC(=O)NCCN
InChIInChI=1S/C5H12N2O/c1-2-5(8)7-4-3-6/h2-4,6H2,1H3,(H,7,8)
InChIKeySUYTZMWLZYCZEF-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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Related Compounds

N-Acetylputrescine
CID 122356
N-Propylacetamide
CID 21407
N-Butylacetamide
CID 61265
N-(2-aminoethyl)acetamide
CID 66082
N-Ethylpropionamide
CID 521324
N-Acetylhomopiperazine
CID 4186202
2-cyano-N-propylacetamide
CID 4429965
N,N'-Diacetylethylenediamine
CID 70097
n-Butyl-2-cyanoacetamide
CID 255865
N-acetylputrescinium
CID 25243990
L-Alanylglycinamide
CID 7019037
Glycyl-l-alaninamide
CID 7019077

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)propanamide?
The IUPAC name of N-(2-aminoethyl)propanamide (CID 4551317) is N-(2-aminoethyl)propanamide.
What is the SMILES notation for N-(2-aminoethyl)propanamide?
The canonical SMILES for N-(2-aminoethyl)propanamide is CCC(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)propanamide?
The InChIKey is SUYTZMWLZYCZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-2-5(8)7-4-3-6/h2-4,6H2,1H3,(H,7,8).
What are the key properties of N-(2-aminoethyl)propanamide?
N-(2-aminoethyl)propanamide 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 N-(2-aminoethyl)propanamide is sourced from PubChem (CID 4551317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).