2-amino-N-benzyl-2-methyl-N-propylbutanamide

C15H24N2O — CID 79797442

IUPAC2-amino-N-benzyl-2-methyl-N-propylbutanamide
SMILESCCCN(Cc1ccccc1)C(=O)C(C)(N)CC
InChIInChI=1S/C15H24N2O/c1-4-11-17(14(18)15(3,16)5-2)12-13-9-7-6-8-10-13/h6-10H,4-5,11-12,16H2,1-3H3
InChIKeyHMZIUOBVJOEQBO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.55
Rot. Bonds6

About 2-amino-N-benzyl-2-methyl-N-propylbutanamide

2-amino-N-benzyl-2-methyl-N-propylbutanamide (PubChem CID 79797442) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-amino-N-benzyl-2-methyl-N-propylbutanamide.

Molecular Properties

Compound Name2-amino-N-benzyl-2-methyl-N-propylbutanamide
PubChem CID79797442
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-amino-N-benzyl-2-methyl-N-propylbutanamide
SMILESCCCN(Cc1ccccc1)C(=O)C(C)(N)CC
InChIInChI=1S/C15H24N2O/c1-4-11-17(14(18)15(3,16)5-2)12-13-9-7-6-8-10-13/h6-10H,4-5,11-12,16H2,1-3H3
InChIKeyHMZIUOBVJOEQBO-UHFFFAOYSA-N
XLogP2.55
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(4-cyanophenyl)methyl]-2-methyl-N-propylbutanamide
CID 79805228
2-amino-N-ethyl-2-methyl-N-(2-phenylethyl)butanamide
CID 79805499
2-amino-N-benzyl-N-ethyl-2-methylpentanamide
CID 60846660
2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride
CID 119674328
2-amino-N,N-dibenzyl-2-ethylbutanamide
CID 130161860
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-N-ethyl-2-methylbutanamide
CID 79805312
N-benzyl-N-(2-hydroxyethyl)-2,2-dimethylbutanamide
CID 62679186
2-(aminomethyl)-N-benzyl-4,4-dimethyl-N-propylpentanamide
CID 107471232
2-amino-N-benzyl-N,2-dimethylpentanamide
CID 60848746
N-benzyl-N-ethyl-N',N'-dipropylpropanediamide
CID 108947326
4-amino-N-benzyl-N-propylbutanamide
CID 43588666
N-benzyl-2-ethoxy-N-propylacetamide
CID 60655890

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-2-methyl-N-propylbutanamide?
The IUPAC name of 2-amino-N-benzyl-2-methyl-N-propylbutanamide (CID 79797442) is 2-amino-N-benzyl-2-methyl-N-propylbutanamide.
What is the SMILES notation for 2-amino-N-benzyl-2-methyl-N-propylbutanamide?
The canonical SMILES for 2-amino-N-benzyl-2-methyl-N-propylbutanamide is CCCN(Cc1ccccc1)C(=O)C(C)(N)CC.
What is the InChIKey of 2-amino-N-benzyl-2-methyl-N-propylbutanamide?
The InChIKey is HMZIUOBVJOEQBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-11-17(14(18)15(3,16)5-2)12-13-9-7-6-8-10-13/h6-10H,4-5,11-12,16H2,1-3H3.
What are the key properties of 2-amino-N-benzyl-2-methyl-N-propylbutanamide?
2-amino-N-benzyl-2-methyl-N-propylbutanamide has a molecular weight of 248.37 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-2-methyl-N-propylbutanamide is sourced from PubChem (CID 79797442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).