N-(3,6-dimethylcycloheptyl)acetamide

C11H21NO — CID 89468976

IUPACN-(3,6-dimethylcycloheptyl)acetamide
SMILESCC(=O)NC1CC(C)CCC(C)C1
InChIInChI=1S/C11H21NO/c1-8-4-5-9(2)7-11(6-8)12-10(3)13/h8-9,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyWPJJMHPKCSUXGP-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.34
Rot. Bonds1

About N-(3,6-dimethylcycloheptyl)acetamide

N-(3,6-dimethylcycloheptyl)acetamide (PubChem CID 89468976) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(3,6-dimethylcycloheptyl)acetamide.

Molecular Properties

Compound NameN-(3,6-dimethylcycloheptyl)acetamide
PubChem CID89468976
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(3,6-dimethylcycloheptyl)acetamide
SMILESCC(=O)NC1CC(C)CCC(C)C1
InChIInChI=1S/C11H21NO/c1-8-4-5-9(2)7-11(6-8)12-10(3)13/h8-9,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyWPJJMHPKCSUXGP-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3S)-3-methylcyclohexyl]acetamide
CID 143244343
ethane;N-(3-methylcyclohexyl)acetamide
CID 156753874
cis-(1S,3R)-3-methylcyclohexane-1-carboxylic acid;N-[(1S,3R)-3-methylcyclohexyl]acetamide
CID 158462495
N-[(1R,2S)-2-chloro-4-methylcyclohexyl]acetamide
CID 166978311
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
N-[(1R,5S)-3,3,5-trimethylcyclohexyl]acetamide
CID 67074228
N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
CID 90040795
N-[(1R,3S)-3-(methylamino)cyclopentyl]acetamide
CID 139574017
N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
CID 59032904
2-methoxy-N-(3-methylcyclopentyl)propanamide
CID 114541432
2-methylbut-1-ene;N-(4-methylcyclohexyl)acetamide
CID 143490442
3-methyl-N-(3-methylcyclopentyl)but-2-enamide
CID 130171283

Frequently Asked Questions

What is the IUPAC name of N-(3,6-dimethylcycloheptyl)acetamide?
The IUPAC name of N-(3,6-dimethylcycloheptyl)acetamide (CID 89468976) is N-(3,6-dimethylcycloheptyl)acetamide.
What is the SMILES notation for N-(3,6-dimethylcycloheptyl)acetamide?
The canonical SMILES for N-(3,6-dimethylcycloheptyl)acetamide is CC(=O)NC1CC(C)CCC(C)C1.
What is the InChIKey of N-(3,6-dimethylcycloheptyl)acetamide?
The InChIKey is WPJJMHPKCSUXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8-4-5-9(2)7-11(6-8)12-10(3)13/h8-9,11H,4-7H2,1-3H3,(H,12,13).
What are the key properties of N-(3,6-dimethylcycloheptyl)acetamide?
N-(3,6-dimethylcycloheptyl)acetamide has a molecular weight of 183.29 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,6-dimethylcycloheptyl)acetamide is sourced from PubChem (CID 89468976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).