N-(2-methylpropyl)cyclohexanecarboxamide

C11H21NO — CID 4642219

IUPACN-(2-methylpropyl)cyclohexanecarboxamide
SMILESCC(C)CNC(=O)C1CCCCC1
InChIInChI=1S/C11H21NO/c1-9(2)8-12-11(13)10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyRVLZJGXLNZAMEA-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.34
Rot. Bonds3

About N-(2-methylpropyl)cyclohexanecarboxamide

N-(2-methylpropyl)cyclohexanecarboxamide (PubChem CID 4642219) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(2-methylpropyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)cyclohexanecarboxamide
PubChem CID4642219
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(2-methylpropyl)cyclohexanecarboxamide
SMILESCC(C)CNC(=O)C1CCCCC1
InChIInChI=1S/C11H21NO/c1-9(2)8-12-11(13)10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyRVLZJGXLNZAMEA-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
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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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)cyclohexanecarboxamide?
The IUPAC name of N-(2-methylpropyl)cyclohexanecarboxamide (CID 4642219) is N-(2-methylpropyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(2-methylpropyl)cyclohexanecarboxamide?
The canonical SMILES for N-(2-methylpropyl)cyclohexanecarboxamide is CC(C)CNC(=O)C1CCCCC1.
What is the InChIKey of N-(2-methylpropyl)cyclohexanecarboxamide?
The InChIKey is RVLZJGXLNZAMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)8-12-11(13)10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-(2-methylpropyl)cyclohexanecarboxamide?
N-(2-methylpropyl)cyclohexanecarboxamide has a molecular weight of 183.29 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)cyclohexanecarboxamide is sourced from PubChem (CID 4642219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).