N-(2-aminobutyl)-2,2-dimethylbutanamide

C10H22N2O — CID 63731375

IUPACN-(2-aminobutyl)-2,2-dimethylbutanamide
SMILESCCC(N)CNC(=O)C(C)(C)CC
InChIInChI=1S/C10H22N2O/c1-5-8(11)7-12-9(13)10(3,4)6-2/h8H,5-7,11H2,1-4H3,(H,12,13)
InChIKeyXHFGUOJVUSXADU-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.28
Rot. Bonds5

About N-(2-aminobutyl)-2,2-dimethylbutanamide

N-(2-aminobutyl)-2,2-dimethylbutanamide (PubChem CID 63731375) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-(2-aminobutyl)-2,2-dimethylbutanamide.

Molecular Properties

Compound NameN-(2-aminobutyl)-2,2-dimethylbutanamide
PubChem CID63731375
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-(2-aminobutyl)-2,2-dimethylbutanamide
SMILESCCC(N)CNC(=O)C(C)(C)CC
InChIInChI=1S/C10H22N2O/c1-5-8(11)7-12-9(13)10(3,4)6-2/h8H,5-7,11H2,1-4H3,(H,12,13)
InChIKeyXHFGUOJVUSXADU-UHFFFAOYSA-N
XLogP1.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-(2-methylpropyl)butanamide
CID 4634733
N-(aminomethyl)-2,2-dimethylbutanamide
CID 20688200
N-(3-bromo-2-methylpropyl)-2,2-dimethylbutanamide
CID 114313422
N-(3-aminobutyl)-2,2-dimethylbutanamide
CID 63253929
N-[(2R)-2-(ethylamino)propyl]-2,2-dimethylbutanamide
CID 120653493
N-(2-aminobutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603389
N-(2-amino-4,4-dimethylpentyl)-2,2-dimethylpropanamide
CID 107158412
N-(2,2-dimethylpropyl)-2,2-dimethylbutanamide
CID 54381373
N-(2-aminobutyl)-4-methylpentanamide
CID 63730752
N-(2-amino-3-ethylpentyl)-2-methoxy-2-methylbutanamide
CID 106285954
N-(2-aminobutyl)-2-cyclopropylacetamide
CID 63733245
N-(4-aminobutyl)-2,2-dimethylbutanamide
CID 62677618

Frequently Asked Questions

What is the IUPAC name of N-(2-aminobutyl)-2,2-dimethylbutanamide?
The IUPAC name of N-(2-aminobutyl)-2,2-dimethylbutanamide (CID 63731375) is N-(2-aminobutyl)-2,2-dimethylbutanamide.
What is the SMILES notation for N-(2-aminobutyl)-2,2-dimethylbutanamide?
The canonical SMILES for N-(2-aminobutyl)-2,2-dimethylbutanamide is CCC(N)CNC(=O)C(C)(C)CC.
What is the InChIKey of N-(2-aminobutyl)-2,2-dimethylbutanamide?
The InChIKey is XHFGUOJVUSXADU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-5-8(11)7-12-9(13)10(3,4)6-2/h8H,5-7,11H2,1-4H3,(H,12,13).
What are the key properties of N-(2-aminobutyl)-2,2-dimethylbutanamide?
N-(2-aminobutyl)-2,2-dimethylbutanamide has a molecular weight of 186.30 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminobutyl)-2,2-dimethylbutanamide is sourced from PubChem (CID 63731375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).