3-(methylamino)-2-methylidenepentanamide

C7H14N2O — CID 22497384

IUPAC3-(methylamino)-2-methylidenepentanamide
SMILESC=C(C(N)=O)C(CC)NC
InChIInChI=1S/C7H14N2O/c1-4-6(9-3)5(2)7(8)10/h6,9H,2,4H2,1,3H3,(H2,8,10)
InChIKeySUHBPENJLKPHFF-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.03
Rot. Bonds4

About 3-(methylamino)-2-methylidenepentanamide

3-(methylamino)-2-methylidenepentanamide (PubChem CID 22497384) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-(methylamino)-2-methylidenepentanamide.

Molecular Properties

Compound Name3-(methylamino)-2-methylidenepentanamide
PubChem CID22497384
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name3-(methylamino)-2-methylidenepentanamide
SMILESC=C(C(N)=O)C(CC)NC
InChIInChI=1S/C7H14N2O/c1-4-6(9-3)5(2)7(8)10/h6,9H,2,4H2,1,3H3,(H2,8,10)
InChIKeySUHBPENJLKPHFF-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-(methylamino)-2-methylidenepentanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-2-methylidenepentanamide?
The IUPAC name of 3-(methylamino)-2-methylidenepentanamide (CID 22497384) is 3-(methylamino)-2-methylidenepentanamide.
What is the SMILES notation for 3-(methylamino)-2-methylidenepentanamide?
The canonical SMILES for 3-(methylamino)-2-methylidenepentanamide is C=C(C(N)=O)C(CC)NC.
What is the InChIKey of 3-(methylamino)-2-methylidenepentanamide?
The InChIKey is SUHBPENJLKPHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-4-6(9-3)5(2)7(8)10/h6,9H,2,4H2,1,3H3,(H2,8,10).
What are the key properties of 3-(methylamino)-2-methylidenepentanamide?
3-(methylamino)-2-methylidenepentanamide has a molecular weight of 142.20 g/mol, XLogP of 0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-2-methylidenepentanamide is sourced from PubChem (CID 22497384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).