3-amino-N,N-dipropylbutanamide

C10H22N2O — CID 60836307

IUPAC3-amino-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(C)N
InChIInChI=1S/C10H22N2O/c1-4-6-12(7-5-2)10(13)8-9(3)11/h9H,4-8,11H2,1-3H3
InChIKeyFGXHYFPNFIHBEX-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.37
Rot. Bonds6

About 3-amino-N,N-dipropylbutanamide

3-amino-N,N-dipropylbutanamide (PubChem CID 60836307) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-amino-N,N-dipropylbutanamide.

Molecular Properties

Compound Name3-amino-N,N-dipropylbutanamide
PubChem CID60836307
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-amino-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(C)N
InChIInChI=1S/C10H22N2O/c1-4-6-12(7-5-2)10(13)8-9(3)11/h9H,4-8,11H2,1-3H3
InChIKeyFGXHYFPNFIHBEX-UHFFFAOYSA-N
XLogP1.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[3-aminobutanoyl(propyl)amino]acetate
CID 60946687
4-amino-3-methyl-N,N-dipropylbutanamide
CID 81070980
3-amino-N-hexyl-N-(2-hydroxyethyl)butanamide
CID 60963416
3-amino-N-[(4-methylphenyl)methyl]-N-propylbutanamide
CID 54869448
3-amino-N-benzyl-N-propylbutanamide;hydrochloride
CID 119681635
3-amino-N-(oxan-2-ylmethyl)-N-propylbutanamide
CID 119777186
3-amino-N-(oxan-2-ylmethyl)-N-propylbutanamide;hydrochloride
CID 119777185
3-(4-aminophenyl)-N,N-dipropylbutanamide
CID 104501970
3-amino-N-(cyclopropylmethyl)-N-ethylbutanamide
CID 63954762
3-amino-N-ethyl-N-[2-(methylamino)-2-oxoethyl]butanamide
CID 60837009
(2S)-2-amino-3-methyl-N,N-dipropylbutanamide
CID 22690786
3-(aminomethyl)-N-(2-hydroxyethyl)-N-propylpentanamide
CID 81086704

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-dipropylbutanamide?
The IUPAC name of 3-amino-N,N-dipropylbutanamide (CID 60836307) is 3-amino-N,N-dipropylbutanamide.
What is the SMILES notation for 3-amino-N,N-dipropylbutanamide?
The canonical SMILES for 3-amino-N,N-dipropylbutanamide is CCCN(CCC)C(=O)CC(C)N.
What is the InChIKey of 3-amino-N,N-dipropylbutanamide?
The InChIKey is FGXHYFPNFIHBEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-6-12(7-5-2)10(13)8-9(3)11/h9H,4-8,11H2,1-3H3.
What are the key properties of 3-amino-N,N-dipropylbutanamide?
3-amino-N,N-dipropylbutanamide has a molecular weight of 186.30 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-dipropylbutanamide is sourced from PubChem (CID 60836307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).