2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide

C13H23NO2 — CID 71856944

IUPAC2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide
SMILESCC1CCCC(NC(=O)C2(C)CCCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-5-3-6-11(9-10)14-12(15)13(2)7-4-8-16-13/h10-11H,3-9H2,1-2H3,(H,14,15)
InChIKeyZWXNZDNOVGQVNM-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.25
Rot. Bonds2

About 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide

2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide (PubChem CID 71856944) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide
PubChem CID71856944
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide
SMILESCC1CCCC(NC(=O)C2(C)CCCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-5-3-6-11(9-10)14-12(15)13(2)7-4-8-16-13/h10-11H,3-9H2,1-2H3,(H,14,15)
InChIKeyZWXNZDNOVGQVNM-UHFFFAOYSA-N
XLogP2.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide?
The IUPAC name of 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide (CID 71856944) is 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide.
What is the SMILES notation for 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide?
The canonical SMILES for 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide is CC1CCCC(NC(=O)C2(C)CCCO2)C1.
What is the InChIKey of 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide?
The InChIKey is ZWXNZDNOVGQVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-10-5-3-6-11(9-10)14-12(15)13(2)7-4-8-16-13/h10-11H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide?
2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide has a molecular weight of 225.33 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methylcyclohexyl)oxolane-2-carboxamide is sourced from PubChem (CID 71856944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).