6-amino-2,2-diethylhexanamide

C10H22N2O — CID 141127196

IUPAC6-amino-2,2-diethylhexanamide
SMILESCCC(CC)(CCCCN)C(N)=O
InChIInChI=1S/C10H22N2O/c1-3-10(4-2,9(12)13)7-5-6-8-11/h3-8,11H2,1-2H3,(H2,12,13)
InChIKeyAVOABXVPXNXGIJ-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.41
Rot. Bonds7

About 6-amino-2,2-diethylhexanamide

6-amino-2,2-diethylhexanamide (PubChem CID 141127196) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 6-amino-2,2-diethylhexanamide.

Molecular Properties

Compound Name6-amino-2,2-diethylhexanamide
PubChem CID141127196
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name6-amino-2,2-diethylhexanamide
SMILESCCC(CC)(CCCCN)C(N)=O
InChIInChI=1S/C10H22N2O/c1-3-10(4-2,9(12)13)7-5-6-8-11/h3-8,11H2,1-2H3,(H2,12,13)
InChIKeyAVOABXVPXNXGIJ-UHFFFAOYSA-N
XLogP1.41
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-amino-2,2-diethylhexanamide 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-ethyl-2-pentylheptanamide
CID 87709137
2-icosyl-2-pentyldocosanamide
CID 175538156
methyl 5-amino-2,2-diethylpentanoate
CID 18784900
2-ethyl-2-propylpentanamide
CID 10352144
(4-carbamoyl-4-ethylhexyl) nitrate
CID 87323993
2,5-diamino-2-methylpentanamide
CID 130907221
5-amino-3,3-diethyl-2-methylidenepentanamide
CID 174827789
18,18-diethylicosan-1-amine
CID 87504312
N-(2-aminoethyl)-2,2-diethyloctanamide;hydrofluoride
CID 175966813
N-(4-aminobutyl)-2,2-dimethylbutanamide
CID 62677618
2,6-diamino-2-methylhexanoic acid
CID 3017540
2,2-diethyltridecanoic acid
CID 138578067

Frequently Asked Questions

What is the IUPAC name of 6-amino-2,2-diethylhexanamide?
The IUPAC name of 6-amino-2,2-diethylhexanamide (CID 141127196) is 6-amino-2,2-diethylhexanamide.
What is the SMILES notation for 6-amino-2,2-diethylhexanamide?
The canonical SMILES for 6-amino-2,2-diethylhexanamide is CCC(CC)(CCCCN)C(N)=O.
What is the InChIKey of 6-amino-2,2-diethylhexanamide?
The InChIKey is AVOABXVPXNXGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-10(4-2,9(12)13)7-5-6-8-11/h3-8,11H2,1-2H3,(H2,12,13).
What are the key properties of 6-amino-2,2-diethylhexanamide?
6-amino-2,2-diethylhexanamide has a molecular weight of 186.30 g/mol, XLogP of 1.41, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2,2-diethylhexanamide is sourced from PubChem (CID 141127196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).