(2S)-2-amino-N-ethyl-5-oxopentanamide

C7H14N2O2 — CID 144523819

IUPAC(2S)-2-amino-N-ethyl-5-oxopentanamide
SMILESCCNC(=O)[C@@H](N)CCC=O
InChIInChI=1S/C7H14N2O2/c1-2-9-7(11)6(8)4-3-5-10/h5-6H,2-4,8H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyLLDIUKJFWVHAFQ-LURJTMIESA-N
MW158.20 g/mol
LogP-0.57
Rot. Bonds5

About (2S)-2-amino-N-ethyl-5-oxopentanamide

(2S)-2-amino-N-ethyl-5-oxopentanamide (PubChem CID 144523819) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-2-amino-N-ethyl-5-oxopentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-ethyl-5-oxopentanamide
PubChem CID144523819
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name(2S)-2-amino-N-ethyl-5-oxopentanamide
SMILESCCNC(=O)[C@@H](N)CCC=O
InChIInChI=1S/C7H14N2O2/c1-2-9-7(11)6(8)4-3-5-10/h5-6H,2-4,8H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyLLDIUKJFWVHAFQ-LURJTMIESA-N
XLogP-0.57
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2S)-2-amino-N-ethyl-5-oxopentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-ethyl-4-oxobutanamide
CID 143988292
2-amino-N-ethyl-4-methylsulfonylbutanamide
CID 24697380
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-5-oxopentanamide
CID 135228994
ethyl (2S)-2-amino-5-oxopentanoate
CID 87968678
(2R)-2-amino-N-ethyl-3-sulfanylpropanamide;hydrochloride
CID 139691176
2-amino-N-ethyl-3-(methylamino)propanamide
CID 89258842
2-amino-N,N'-diethylpropanediamide
CID 88901749
(2R)-2-amino-3-cyclopropyl-N-ethylpropanamide
CID 82668057
2-amino-N-ethyl-3-ethylsulfanylpropanamide
CID 13059396
2-amino-N-propylpentanamide
CID 43649977
3-(ethylamino)-2-formyl-3-oxopropanoic acid
CID 89043660
(2S)-2-amino-N-[1-(ethylamino)-1-oxopropan-2-yl]hexanamide
CID 103831075

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-ethyl-5-oxopentanamide?
The IUPAC name of (2S)-2-amino-N-ethyl-5-oxopentanamide (CID 144523819) is (2S)-2-amino-N-ethyl-5-oxopentanamide.
What is the SMILES notation for (2S)-2-amino-N-ethyl-5-oxopentanamide?
The canonical SMILES for (2S)-2-amino-N-ethyl-5-oxopentanamide is CCNC(=O)[C@@H](N)CCC=O.
What is the InChIKey of (2S)-2-amino-N-ethyl-5-oxopentanamide?
The InChIKey is LLDIUKJFWVHAFQ-LURJTMIESA-N. The full InChI is InChI=1S/C7H14N2O2/c1-2-9-7(11)6(8)4-3-5-10/h5-6H,2-4,8H2,1H3,(H,9,11)/t6-/m0/s1.
What are the key properties of (2S)-2-amino-N-ethyl-5-oxopentanamide?
(2S)-2-amino-N-ethyl-5-oxopentanamide has a molecular weight of 158.20 g/mol, XLogP of -0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-ethyl-5-oxopentanamide is sourced from PubChem (CID 144523819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).