ethane;methanamine;N,3,3,5-tetramethylhexanamide

C13H32N2O — CID 177024213

IUPACethane;methanamine;N,3,3,5-tetramethylhexanamide
SMILESCC.CN.CNC(=O)CC(C)(C)CC(C)C
InChIInChI=1S/C10H21NO.C2H6.CH5N/c1-8(2)6-10(3,4)7-9(12)11-5;2*1-2/h8H,6-7H2,1-5H3,(H,11,12);1-2H3;2H2,1H3
InChIKeyGSNSQLMWWSSWDT-UHFFFAOYSA-N
MW232.41 g/mol
LogP2.80
Rot. Bonds4

About ethane;methanamine;N,3,3,5-tetramethylhexanamide

ethane;methanamine;N,3,3,5-tetramethylhexanamide (PubChem CID 177024213) has the molecular formula C13H32N2O and a molecular weight of 232.41 g/mol. Its IUPAC name is ethane;methanamine;N,3,3,5-tetramethylhexanamide.

Molecular Properties

Compound Nameethane;methanamine;N,3,3,5-tetramethylhexanamide
PubChem CID177024213
Molecular FormulaC13H32N2O
Molecular Weight232.41 g/mol
Exact Mass232.25
IUPAC Nameethane;methanamine;N,3,3,5-tetramethylhexanamide
SMILESCC.CN.CNC(=O)CC(C)(C)CC(C)C
InChIInChI=1S/C10H21NO.C2H6.CH5N/c1-8(2)6-10(3,4)7-9(12)11-5;2*1-2/h8H,6-7H2,1-5H3,(H,11,12);1-2H3;2H2,1H3
InChIKeyGSNSQLMWWSSWDT-UHFFFAOYSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.41
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;methanamine;N,3,3,5-tetramethylhexanamide 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

N,N',3,3,6,6-hexamethyloctanediamide
CID 54555561
ethane;N,2,2,4-tetramethylpentanamide
CID 143818563
N,3,3,5,5-pentamethylhexanamide
CID 134573804
4,4,6-trimethyl-2-oxoheptanoyl chloride
CID 88803319
ethane;N,N',2,2,4-pentamethylhexanediamide
CID 156649253
2-(methylamino)-N-(2,2,4-trimethylpentyl)acetamide;hydrochloride
CID 119820253
ethane;3-ethyl-N,5-dimethylhexanamide
CID 177048526
(2S)-2-hydroxy-N',2-dimethylbutanediamide
CID 173099192
tert-butyl 3,3,5-trimethylhexaneperoxoate
CID 18963177
(3R)-3-amino-N-methylbutanamide;hydrochloride
CID 87931451
N',2,2,4-tetramethylpentanehydrazide
CID 116847123
2-amino-4,4,6,6,8-pentamethylnonanoic acid
CID 145315535

Frequently Asked Questions

What is the IUPAC name of ethane;methanamine;N,3,3,5-tetramethylhexanamide?
The IUPAC name of ethane;methanamine;N,3,3,5-tetramethylhexanamide (CID 177024213) is ethane;methanamine;N,3,3,5-tetramethylhexanamide.
What is the SMILES notation for ethane;methanamine;N,3,3,5-tetramethylhexanamide?
The canonical SMILES for ethane;methanamine;N,3,3,5-tetramethylhexanamide is CC.CN.CNC(=O)CC(C)(C)CC(C)C.
What is the InChIKey of ethane;methanamine;N,3,3,5-tetramethylhexanamide?
The InChIKey is GSNSQLMWWSSWDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.C2H6.CH5N/c1-8(2)6-10(3,4)7-9(12)11-5;2*1-2/h8H,6-7H2,1-5H3,(H,11,12);1-2H3;2H2,1H3.
What are the key properties of ethane;methanamine;N,3,3,5-tetramethylhexanamide?
ethane;methanamine;N,3,3,5-tetramethylhexanamide has a molecular weight of 232.41 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methanamine;N,3,3,5-tetramethylhexanamide is sourced from PubChem (CID 177024213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).