2-[butyl(methyl)amino]propanamide

C8H18N2O — CID 60644986

IUPAC2-[butyl(methyl)amino]propanamide
SMILESCCCCN(C)C(C)C(N)=O
InChIInChI=1S/C8H18N2O/c1-4-5-6-10(3)7(2)8(9)11/h7H,4-6H2,1-3H3,(H2,9,11)
InChIKeyBEAOTXCYENZODS-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.59
Rot. Bonds5

About 2-[butyl(methyl)amino]propanamide

2-[butyl(methyl)amino]propanamide (PubChem CID 60644986) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-[butyl(methyl)amino]propanamide.

Molecular Properties

Compound Name2-[butyl(methyl)amino]propanamide
PubChem CID60644986
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-[butyl(methyl)amino]propanamide
SMILESCCCCN(C)C(C)C(N)=O
InChIInChI=1S/C8H18N2O/c1-4-5-6-10(3)7(2)8(9)11/h7H,4-6H2,1-3H3,(H2,9,11)
InChIKeyBEAOTXCYENZODS-UHFFFAOYSA-N
XLogP0.59
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[butyl(methyl)amino]propanamide 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-[3-(dimethylamino)propyl-methylamino]propanamide
CID 63698900
2-[butyl(methyl)amino]-3-methylbutanamide
CID 82040476
ethane;2-[ethyl(methyl)amino]propanamide
CID 176567778
methyl (2S)-2-[methyl(pentyl)amino]propanoate
CID 21097433
2-(dipropylamino)propanamide
CID 18474126
2-[dodecyl(methyl)amino]-N'-hydroxypropanimidamide
CID 76997749
2-[methyl(2-phenylethyl)amino]propanamide
CID 47280413
ethyl 2-[5-hydroxypentyl(methyl)amino]propanoate
CID 103768211
2-[butyl(methyl)amino]-3-methylbutanoyl chloride
CID 82040614
2-[3-(4-fluorophenoxy)propyl-methylamino]propanamide
CID 46444990
2-[butyl(methyl)amino]-N-ethyl-N-phenylpropanamide
CID 78821968
methyl 2-amino-4-[butyl(methyl)amino]-2-methylpentanoate
CID 64725725

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(methyl)amino]propanamide?
The IUPAC name of 2-[butyl(methyl)amino]propanamide (CID 60644986) is 2-[butyl(methyl)amino]propanamide.
What is the SMILES notation for 2-[butyl(methyl)amino]propanamide?
The canonical SMILES for 2-[butyl(methyl)amino]propanamide is CCCCN(C)C(C)C(N)=O.
What is the InChIKey of 2-[butyl(methyl)amino]propanamide?
The InChIKey is BEAOTXCYENZODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-4-5-6-10(3)7(2)8(9)11/h7H,4-6H2,1-3H3,(H2,9,11).
What are the key properties of 2-[butyl(methyl)amino]propanamide?
2-[butyl(methyl)amino]propanamide has a molecular weight of 158.24 g/mol, XLogP of 0.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(methyl)amino]propanamide is sourced from PubChem (CID 60644986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).