N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide

C12H19NO2 — CID 130553196

IUPACN,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide
SMILESCN(C(=O)C1(C)CC1)C1CCC(=O)CC1
InChIInChI=1S/C12H19NO2/c1-12(7-8-12)11(15)13(2)9-3-5-10(14)6-4-9/h9H,3-8H2,1-2H3
InChIKeyTYAVLDSRNDOYML-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.76
Rot. Bonds2

About N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide

N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide (PubChem CID 130553196) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide
PubChem CID130553196
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC NameN,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide
SMILESCN(C(=O)C1(C)CC1)C1CCC(=O)CC1
InChIInChI=1S/C12H19NO2/c1-12(7-8-12)11(15)13(2)9-3-5-10(14)6-4-9/h9H,3-8H2,1-2H3
InChIKeyTYAVLDSRNDOYML-UHFFFAOYSA-N
XLogP1.76
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide?
The IUPAC name of N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide (CID 130553196) is N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide?
The canonical SMILES for N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide is CN(C(=O)C1(C)CC1)C1CCC(=O)CC1.
What is the InChIKey of N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide?
The InChIKey is TYAVLDSRNDOYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-12(7-8-12)11(15)13(2)9-3-5-10(14)6-4-9/h9H,3-8H2,1-2H3.
What are the key properties of N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide?
N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide has a molecular weight of 209.29 g/mol, XLogP of 1.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(4-oxocyclohexyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 130553196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).