N-(2-methylpropyl)cyclooctanecarboxamide

C13H25NO — CID 65022959

IUPACN-(2-methylpropyl)cyclooctanecarboxamide
SMILESCC(C)CNC(=O)C1CCCCCCC1
InChIInChI=1S/C13H25NO/c1-11(2)10-14-13(15)12-8-6-4-3-5-7-9-12/h11-12H,3-10H2,1-2H3,(H,14,15)
InChIKeyOGRCJLADOLQXOY-UHFFFAOYSA-N
MW211.35 g/mol
LogP3.12
Rot. Bonds3

About N-(2-methylpropyl)cyclooctanecarboxamide

N-(2-methylpropyl)cyclooctanecarboxamide (PubChem CID 65022959) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is N-(2-methylpropyl)cyclooctanecarboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)cyclooctanecarboxamide
PubChem CID65022959
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC NameN-(2-methylpropyl)cyclooctanecarboxamide
SMILESCC(C)CNC(=O)C1CCCCCCC1
InChIInChI=1S/C13H25NO/c1-11(2)10-14-13(15)12-8-6-4-3-5-7-9-12/h11-12H,3-10H2,1-2H3,(H,14,15)
InChIKeyOGRCJLADOLQXOY-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-chloropropyl)cyclopentanecarboxamide
CID 114296250
N-(3-bromo-2-methylpropyl)cyclooctanecarboxamide
CID 114313551
N-(2-amino-4-methylpentyl)cyclooctanecarboxamide
CID 107158623
2-[2-(cyclohexanecarbonyl)hydrazinyl]-N-(2-methylpropyl)-2-oxoacetamide
CID 3139316
N-(2-amino-3-hydroxybutyl)cycloheptanecarboxamide
CID 64539549
N-(2-cyanopropyl)cyclooctanecarboxamide
CID 65018661
4-N-(2-methylpropyl)-1-N-propylcyclohexane-1,4-dicarboxamide
CID 109144258
N-(4-bromo-2-methylbutyl)cyclopentanecarboxamide
CID 114316713
N,1-bis(2-methylpropyl)piperidine-4-carboxamide
CID 883892
N-(3-amino-3-hydroxyimino-2-methylpropyl)cycloheptanecarboxamide
CID 76948246
2-(2-methylpropylcarbamoyl)cyclohexane-1-carboxylic acid
CID 3133162
methyl 2-bromo-3-(cyclohexanecarbonylamino)propanoate
CID 103492560

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)cyclooctanecarboxamide?
The IUPAC name of N-(2-methylpropyl)cyclooctanecarboxamide (CID 65022959) is N-(2-methylpropyl)cyclooctanecarboxamide.
What is the SMILES notation for N-(2-methylpropyl)cyclooctanecarboxamide?
The canonical SMILES for N-(2-methylpropyl)cyclooctanecarboxamide is CC(C)CNC(=O)C1CCCCCCC1.
What is the InChIKey of N-(2-methylpropyl)cyclooctanecarboxamide?
The InChIKey is OGRCJLADOLQXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(2)10-14-13(15)12-8-6-4-3-5-7-9-12/h11-12H,3-10H2,1-2H3,(H,14,15).
What are the key properties of N-(2-methylpropyl)cyclooctanecarboxamide?
N-(2-methylpropyl)cyclooctanecarboxamide has a molecular weight of 211.35 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)cyclooctanecarboxamide is sourced from PubChem (CID 65022959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).