3-amino-N-ethyl-2-methylidenepentanamide

C8H16N2O — CID 87980926

IUPAC3-amino-N-ethyl-2-methylidenepentanamide
SMILESC=C(C(=O)NCC)C(N)CC
InChIInChI=1S/C8H16N2O/c1-4-7(9)6(3)8(11)10-5-2/h7H,3-5,9H2,1-2H3,(H,10,11)
InChIKeyURRNGWGISAJWBW-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.42
Rot. Bonds4

About 3-amino-N-ethyl-2-methylidenepentanamide

3-amino-N-ethyl-2-methylidenepentanamide (PubChem CID 87980926) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 3-amino-N-ethyl-2-methylidenepentanamide.

Molecular Properties

Compound Name3-amino-N-ethyl-2-methylidenepentanamide
PubChem CID87980926
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name3-amino-N-ethyl-2-methylidenepentanamide
SMILESC=C(C(=O)NCC)C(N)CC
InChIInChI=1S/C8H16N2O/c1-4-7(9)6(3)8(11)10-5-2/h7H,3-5,9H2,1-2H3,(H,10,11)
InChIKeyURRNGWGISAJWBW-UHFFFAOYSA-N
XLogP0.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-amino-N-ethyl-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

Related Compounds

5-Methyl-3-methylidenepyrrolidin-2-one
CID 23088885
4-Isopropenylazetidin-2-one
CID 17889139
n,n-Dimethyl aminopropyl acrylamide
CID 18505968
N-butan-2-yl-5,5,5-trifluoro-2-methylidenepentanamide
CID 164554142
6,6,6-trifluoro-3-(methylamino)-2-methylidene-N-prop-2-enylhexanamide
CID 143356426
N-isopropyl-2-propylacrylamide
CID 14418380
3-(Tert-butylamino)-2-methylidenepentanamide
CID 18679984
2-Carbamoylpent-1-en-3-yl(trimethyl)azanium
CID 18798178
2-methyl-N-[3-(pentan-3-ylamino)propyl]prop-2-enamide
CID 18947368
3-(Dibutylamino)-2-methylidenepentanamide
CID 18997958
2-Carbamoylpent-1-en-3-yl(trimethyl)azanium chloride
CID 19068797
N-(2-aminoethyl)-2-methylidene-N-propylpentanamide
CID 19764256

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-2-methylidenepentanamide?
The IUPAC name of 3-amino-N-ethyl-2-methylidenepentanamide (CID 87980926) is 3-amino-N-ethyl-2-methylidenepentanamide.
What is the SMILES notation for 3-amino-N-ethyl-2-methylidenepentanamide?
The canonical SMILES for 3-amino-N-ethyl-2-methylidenepentanamide is C=C(C(=O)NCC)C(N)CC.
What is the InChIKey of 3-amino-N-ethyl-2-methylidenepentanamide?
The InChIKey is URRNGWGISAJWBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-7(9)6(3)8(11)10-5-2/h7H,3-5,9H2,1-2H3,(H,10,11).
What are the key properties of 3-amino-N-ethyl-2-methylidenepentanamide?
3-amino-N-ethyl-2-methylidenepentanamide has a molecular weight of 156.23 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-2-methylidenepentanamide is sourced from PubChem (CID 87980926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).