N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide

C13H21NO — CID 79600191

IUPACN-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide
SMILESO=C(NC1CCCCC1)C1C2CCCC21
InChIInChI=1S/C13H21NO/c15-13(12-10-7-4-8-11(10)12)14-9-5-2-1-3-6-9/h9-12H,1-8H2,(H,14,15)
InChIKeyIIVGFKLQRHRHIG-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.48
Rot. Bonds2

About N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide

N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 79600191) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide
PubChem CID79600191
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide
SMILESO=C(NC1CCCCC1)C1C2CCCC21
InChIInChI=1S/C13H21NO/c15-13(12-10-7-4-8-11(10)12)14-9-5-2-1-3-6-9/h9-12H,1-8H2,(H,14,15)
InChIKeyIIVGFKLQRHRHIG-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,8R)-N-cyclohexylbicyclo[6.1.0]non-4-ene-9-carboxamide
CID 814819
N-(4-aminocyclohexyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81478190
N-piperidin-4-ylbicyclo[4.1.0]heptane-7-carboxamide;hydrochloride
CID 119388101
(1R,4R,6R,9R)-10,10-dichloro-N-cyclohexyltricyclo[7.1.0.04,6]decane-5-carboxamide
CID 98349175
N-piperidin-3-ylbicyclo[4.1.0]heptane-7-carboxamide;hydrochloride
CID 119426705
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cyclopentylcyclobutanecarboxamide
CID 21158774
1-cyclobutyl-3-cyclohexylurea
CID 17217147
(1R,6R)-N-[(3R)-1,1-dioxothiolan-3-yl]bicyclo[4.1.0]heptane-7-carboxamide
CID 98205718
1-N,2-N-dicyclohexylcyclopropane-1,2-dicarboxamide
CID 109132364

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide (CID 79600191) is N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide is O=C(NC1CCCCC1)C1C2CCCC21.
What is the InChIKey of N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is IIVGFKLQRHRHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c15-13(12-10-7-4-8-11(10)12)14-9-5-2-1-3-6-9/h9-12H,1-8H2,(H,14,15).
What are the key properties of N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide?
N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 207.32 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylbicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 79600191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).