4-amino-N-formylpentanamide

C6H12N2O2 — CID 143583899

IUPAC4-amino-N-formylpentanamide
SMILESCC(N)CCC(=O)NC=O
InChIInChI=1S/C6H12N2O2/c1-5(7)2-3-6(10)8-4-9/h4-5H,2-3,7H2,1H3,(H,8,9,10)
InChIKeyOFPKCXUBOOPWJU-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.61
Rot. Bonds4

About 4-amino-N-formylpentanamide

4-amino-N-formylpentanamide (PubChem CID 143583899) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 4-amino-N-formylpentanamide.

Molecular Properties

Compound Name4-amino-N-formylpentanamide
PubChem CID143583899
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name4-amino-N-formylpentanamide
SMILESCC(N)CCC(=O)NC=O
InChIInChI=1S/C6H12N2O2/c1-5(7)2-3-6(10)8-4-9/h4-5H,2-3,7H2,1H3,(H,8,9,10)
InChIKeyOFPKCXUBOOPWJU-UHFFFAOYSA-N
XLogP-0.61
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-5-formamido-5-oxopentanoic acid
CID 54145415
4-amino-N-(2-oxoethyl)pentanamide
CID 143686044
4-amino-N-(2-methylprop-2-enyl)pentanamide
CID 114617045
(4R)-4-amino-N-propylpentanamide
CID 146234117
4-aminopentanoic acid;ethane
CID 143436801
(2R)-2-amino-4-formamido-4-oxobutanoic acid
CID 131868745
diethyl 2-(4-aminopentanoylamino)propanedioate;hydrochloride
CID 120559501
4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride
CID 120563103
4-amino-N-(2-methoxypropyl)pentanamide
CID 102694842
5-amino-N-cyanohexanamide
CID 82852451
(Z)-N-formylbut-2-enamide;3-methylbutan-1-ol
CID 171813190
5-amino-N-pentan-3-ylhexanamide
CID 82848944

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-formylpentanamide?
The IUPAC name of 4-amino-N-formylpentanamide (CID 143583899) is 4-amino-N-formylpentanamide.
What is the SMILES notation for 4-amino-N-formylpentanamide?
The canonical SMILES for 4-amino-N-formylpentanamide is CC(N)CCC(=O)NC=O.
What is the InChIKey of 4-amino-N-formylpentanamide?
The InChIKey is OFPKCXUBOOPWJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-5(7)2-3-6(10)8-4-9/h4-5H,2-3,7H2,1H3,(H,8,9,10).
What are the key properties of 4-amino-N-formylpentanamide?
4-amino-N-formylpentanamide has a molecular weight of 144.17 g/mol, XLogP of -0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-formylpentanamide is sourced from PubChem (CID 143583899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).