4-amino-3-methyl-N,N-dipropylbutanamide

C11H24N2O — CID 81070980

IUPAC4-amino-3-methyl-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(C)CN
InChIInChI=1S/C11H24N2O/c1-4-6-13(7-5-2)11(14)8-10(3)9-12/h10H,4-9,12H2,1-3H3
InChIKeyKNHZNJAXZAFCTG-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.62
Rot. Bonds7

About 4-amino-3-methyl-N,N-dipropylbutanamide

4-amino-3-methyl-N,N-dipropylbutanamide (PubChem CID 81070980) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-amino-3-methyl-N,N-dipropylbutanamide.

Molecular Properties

Compound Name4-amino-3-methyl-N,N-dipropylbutanamide
PubChem CID81070980
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-amino-3-methyl-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(C)CN
InChIInChI=1S/C11H24N2O/c1-4-6-13(7-5-2)11(14)8-10(3)9-12/h10H,4-9,12H2,1-3H3
InChIKeyKNHZNJAXZAFCTG-UHFFFAOYSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N,N-bis(2-ethoxyethyl)-3-methylbutanamide
CID 82964992
3-amino-N,N-dipropylbutanamide
CID 60836307
4-amino-N,N-bis(2-cyanoethyl)-3-methylbutanamide
CID 81087572
4-amino-3-methyl-N,N-bis(prop-2-enyl)butanamide
CID 81070887
3-(aminomethyl)-N-(2-hydroxyethyl)-N-propylpentanamide
CID 81086704
4-amino-N-butan-2-yl-N,3-dimethylbutanamide
CID 81072119
4-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-methylbutanamide
CID 107479371
4-amino-N,3-dimethyl-N-(4-methylpentan-2-yl)butanamide
CID 81086981
3-(4-aminophenyl)-N,N-dipropylbutanamide
CID 104501970
3-(aminomethyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide
CID 81087870
2-[propyl(3,5,5-trimethylhexanoyl)amino]acetic acid
CID 61012350
2-(3-hydroxy-2-methylpropyl)sulfanyl-N,N-dipropylacetamide
CID 66103337

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N,N-dipropylbutanamide?
The IUPAC name of 4-amino-3-methyl-N,N-dipropylbutanamide (CID 81070980) is 4-amino-3-methyl-N,N-dipropylbutanamide.
What is the SMILES notation for 4-amino-3-methyl-N,N-dipropylbutanamide?
The canonical SMILES for 4-amino-3-methyl-N,N-dipropylbutanamide is CCCN(CCC)C(=O)CC(C)CN.
What is the InChIKey of 4-amino-3-methyl-N,N-dipropylbutanamide?
The InChIKey is KNHZNJAXZAFCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-6-13(7-5-2)11(14)8-10(3)9-12/h10H,4-9,12H2,1-3H3.
What are the key properties of 4-amino-3-methyl-N,N-dipropylbutanamide?
4-amino-3-methyl-N,N-dipropylbutanamide has a molecular weight of 200.33 g/mol, XLogP of 1.62, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methyl-N,N-dipropylbutanamide is sourced from PubChem (CID 81070980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).