N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide

C13H23NO — CID 146534371

IUPACN-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide
SMILESCC(=O)NC1CC(C)C2C(C1)C2C(C)C
InChIInChI=1S/C13H23NO/c1-7(2)12-11-6-10(14-9(4)15)5-8(3)13(11)12/h7-8,10-13H,5-6H2,1-4H3,(H,14,15)
InChIKeyPWVWDQKOCJXOGS-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.44
Rot. Bonds2

About N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide

N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide (PubChem CID 146534371) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide.

Molecular Properties

Compound NameN-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide
PubChem CID146534371
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC NameN-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide
SMILESCC(=O)NC1CC(C)C2C(C1)C2C(C)C
InChIInChI=1S/C13H23NO/c1-7(2)12-11-6-10(14-9(4)15)5-8(3)13(11)12/h7-8,10-13H,5-6H2,1-4H3,(H,14,15)
InChIKeyPWVWDQKOCJXOGS-UHFFFAOYSA-N
XLogP2.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)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

N-(3-propan-2-ylcyclobutyl)acetamide
CID 59410589
N-[(5R)-6-methyl-3-bicyclo[3.2.0]heptanyl]acetamide
CID 166848885
N-(3-iodocyclobutyl)acetamide
CID 145126673
N-(3,6-dimethylcycloheptyl)acetamide
CID 89468976
N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
CID 90040795
N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
CID 59032904
(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid
CID 178194513
2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide
CID 142811143
N-[(1R,3S)-3-(propan-2-ylamino)cyclohexyl]acetamide
CID 139573748
N-(2,7-dimethyloxepan-4-yl)acetamide
CID 175623510
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
N-[(3S)-3-methylcyclohexyl]acetamide
CID 143244343

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide?
The IUPAC name of N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide (CID 146534371) is N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide.
What is the SMILES notation for N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide?
The canonical SMILES for N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide is CC(=O)NC1CC(C)C2C(C1)C2C(C)C.
What is the InChIKey of N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide?
The InChIKey is PWVWDQKOCJXOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-7(2)12-11-6-10(14-9(4)15)5-8(3)13(11)12/h7-8,10-13H,5-6H2,1-4H3,(H,14,15).
What are the key properties of N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide?
N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide has a molecular weight of 209.33 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide is sourced from PubChem (CID 146534371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).