ethane;N-(2-methylpropyl)acetamide

C8H19NO — CID 142232237

IUPACethane;N-(2-methylpropyl)acetamide
SMILESCC.CC(=O)NCC(C)C
InChIInChI=1S/C6H13NO.C2H6/c1-5(2)4-7-6(3)8;1-2/h5H,4H2,1-3H3,(H,7,8);1-2H3
InChIKeyCCVHSFVONAEWAZ-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.80
Rot. Bonds2

About ethane;N-(2-methylpropyl)acetamide

ethane;N-(2-methylpropyl)acetamide (PubChem CID 142232237) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is ethane;N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Nameethane;N-(2-methylpropyl)acetamide
PubChem CID142232237
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Nameethane;N-(2-methylpropyl)acetamide
SMILESCC.CC(=O)NCC(C)C
InChIInChI=1S/C6H13NO.C2H6/c1-5(2)4-7-6(3)8;1-2/h5H,4H2,1-3H3,(H,7,8);1-2H3
InChIKeyCCVHSFVONAEWAZ-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze ethane;N-(2-methylpropyl)acetamide 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-methylpropan-1-amine;N-(2-methylpropyl)acetamide
CID 161466003
1,3-dimethoxypropane;ethane;N-(2-methylpropyl)acetamide;molecular hydrogen
CID 169251341
N-(3-acetamido-2-methylpropyl)acetamide
CID 20588188
N-(2,3-dihydroxybutyl)acetamide
CID 91533638
N-(2-methoxypropyl)acetamide
CID 90876780
N-[(2R)-2,3,3-trimethylbutyl]acetamide
CID 59118608
ethane;N-(2-methylpropyl)acetamide;3,3,4-trimethylmorpholine
CID 163271444
N-(2-methylpropyl)-2,4-dioxopentanamide
CID 123533018
ethane;N-(3-hydroxy-2-sulfanylpropyl)acetamide
CID 145429935
(E)-2-methyl-N-(2-methylpropyl)but-2-enamide
CID 57408889
ethane;methyl 3-(acetamidomethyl)-5-methylhexanoate
CID 156715100
2,3-dibromo-N-(2-methylpropyl)propanamide
CID 21396704

Frequently Asked Questions

What is the IUPAC name of ethane;N-(2-methylpropyl)acetamide?
The IUPAC name of ethane;N-(2-methylpropyl)acetamide (CID 142232237) is ethane;N-(2-methylpropyl)acetamide.
What is the SMILES notation for ethane;N-(2-methylpropyl)acetamide?
The canonical SMILES for ethane;N-(2-methylpropyl)acetamide is CC.CC(=O)NCC(C)C.
What is the InChIKey of ethane;N-(2-methylpropyl)acetamide?
The InChIKey is CCVHSFVONAEWAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C2H6/c1-5(2)4-7-6(3)8;1-2/h5H,4H2,1-3H3,(H,7,8);1-2H3.
What are the key properties of ethane;N-(2-methylpropyl)acetamide?
ethane;N-(2-methylpropyl)acetamide has a molecular weight of 145.25 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(2-methylpropyl)acetamide is sourced from PubChem (CID 142232237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).