N-methoxy-N,4-dimethylcyclohexane-1-carboxamide

C10H19NO2 — CID 11309937

IUPACN-methoxy-N,4-dimethylcyclohexane-1-carboxamide
SMILESCON(C)C(=O)C1CCC(C)CC1
InChIInChI=1S/C10H19NO2/c1-8-4-6-9(7-5-8)10(12)11(2)13-3/h8-9H,4-7H2,1-3H3
InChIKeyWIWTTWJLHKRXQH-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.83
Rot. Bonds2

About N-methoxy-N,4-dimethylcyclohexane-1-carboxamide

N-methoxy-N,4-dimethylcyclohexane-1-carboxamide (PubChem CID 11309937) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-methoxy-N,4-dimethylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-N,4-dimethylcyclohexane-1-carboxamide
PubChem CID11309937
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-methoxy-N,4-dimethylcyclohexane-1-carboxamide
SMILESCON(C)C(=O)C1CCC(C)CC1
InChIInChI=1S/C10H19NO2/c1-8-4-6-9(7-5-8)10(12)11(2)13-3/h8-9H,4-7H2,1-3H3
InChIKeyWIWTTWJLHKRXQH-UHFFFAOYSA-N
XLogP1.83
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,4-dimethylcyclohexane-1-carboxamide?
The IUPAC name of N-methoxy-N,4-dimethylcyclohexane-1-carboxamide (CID 11309937) is N-methoxy-N,4-dimethylcyclohexane-1-carboxamide.
What is the SMILES notation for N-methoxy-N,4-dimethylcyclohexane-1-carboxamide?
The canonical SMILES for N-methoxy-N,4-dimethylcyclohexane-1-carboxamide is CON(C)C(=O)C1CCC(C)CC1.
What is the InChIKey of N-methoxy-N,4-dimethylcyclohexane-1-carboxamide?
The InChIKey is WIWTTWJLHKRXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8-4-6-9(7-5-8)10(12)11(2)13-3/h8-9H,4-7H2,1-3H3.
What are the key properties of N-methoxy-N,4-dimethylcyclohexane-1-carboxamide?
N-methoxy-N,4-dimethylcyclohexane-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,4-dimethylcyclohexane-1-carboxamide is sourced from PubChem (CID 11309937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).