N,N-dicyclohexylnitrous amide

C12H22N2O — CID 13697

IUPACN,N-dicyclohexylnitrous amide
SMILESO=NN(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C12H22N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKeyCYMNKXLBEMEABS-UHFFFAOYSA-N
MW210.32 g/mol
LogP3.64
Rot. Bonds3

About N,N-dicyclohexylnitrous amide

N,N-dicyclohexylnitrous amide (PubChem CID 13697) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N,N-dicyclohexylnitrous amide.

Molecular Properties

Compound NameN,N-dicyclohexylnitrous amide
PubChem CID13697
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN,N-dicyclohexylnitrous amide
SMILESO=NN(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C12H22N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKeyCYMNKXLBEMEABS-UHFFFAOYSA-N
XLogP3.64
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-N-nitrosoacetamide
CID 13464904
azane;(dicyclohexylamino) nitrite
CID 87489236
1-cycloheptyl-1,2,2-tricyclohexylhydrazine
CID 139397453
N,N-dicyclohexylcyclohexanamine
CID 175770337
1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine
CID 20530659
nitrosocyclopentadecane
CID 89341033
N-cyclobutyl-N-methylcyclohexanamine
CID 90984290
nitrosocycloheptane
CID 54252877
N-cyclobutyl-N-nitrosoacetamide
CID 119097713
2-[[cyclohexyl(methyl)amino]-nitrosoamino]acetamide
CID 54018286
1-cyclohexyl-1-cyclopropylhydrazine
CID 22132585
N-cyclopropyl-N-methylcyclooctanamine
CID 67119180

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexylnitrous amide?
The IUPAC name of N,N-dicyclohexylnitrous amide (CID 13697) is N,N-dicyclohexylnitrous amide.
What is the SMILES notation for N,N-dicyclohexylnitrous amide?
The canonical SMILES for N,N-dicyclohexylnitrous amide is O=NN(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexylnitrous amide?
The InChIKey is CYMNKXLBEMEABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2.
What are the key properties of N,N-dicyclohexylnitrous amide?
N,N-dicyclohexylnitrous amide has a molecular weight of 210.32 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexylnitrous amide is sourced from PubChem (CID 13697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).