1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide

C10H17N3O — CID 78974832

IUPAC1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide
SMILESCN(C)NC(=O)C1(C#N)CCCCC1
InChIInChI=1S/C10H17N3O/c1-13(2)12-9(14)10(8-11)6-4-3-5-7-10/h3-7H2,1-2H3,(H,12,14)
InChIKeyFLRRRUABWXDBEP-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.05
Rot. Bonds2

About 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide

1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide (PubChem CID 78974832) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide.

Molecular Properties

Compound Name1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide
PubChem CID78974832
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide
SMILESCN(C)NC(=O)C1(C#N)CCCCC1
InChIInChI=1S/C10H17N3O/c1-13(2)12-9(14)10(8-11)6-4-3-5-7-10/h3-7H2,1-2H3,(H,12,14)
InChIKeyFLRRRUABWXDBEP-UHFFFAOYSA-N
XLogP1.05
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-cyano-N-[3-(dimethylamino)-2,2-dimethylpropyl]cyclohexane-1-carboxamide
CID 61459075
1-cyano-N-[2-[ethyl(methyl)amino]-2-oxoethyl]cyclopentane-1-carboxamide
CID 104920281
1-cyano-N-[1-(dimethylamino)propan-2-yl]cycloheptane-1-carboxamide
CID 82938688
1-cyano-N-(1-ethylcyclobutyl)cyclohexane-1-carboxamide
CID 113488783
1-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
CID 83021408
1-cyano-N-(3-ethylpentan-3-yl)cyclohexane-1-carboxamide
CID 65043719
1-acetylcyclohexane-1-carbonitrile
CID 18340732
1-cyano-N-methyl-N-propylcycloheptane-1-carboxamide
CID 55207638
1-cyano-N-[1-(methylamino)-1-oxopropan-2-yl]cyclohexane-1-carboxamide
CID 61461956
1-cyano-N-[(2S)-1-hydroxypropan-2-yl]cyclohexane-1-carboxamide
CID 103820750
1-cyano-N-[2-(ethylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 61461650
1-cyano-N-(3-methylcyclobutyl)cyclohexane-1-carboxamide
CID 115671011

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide?
The IUPAC name of 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide (CID 78974832) is 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide.
What is the SMILES notation for 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide?
The canonical SMILES for 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide is CN(C)NC(=O)C1(C#N)CCCCC1.
What is the InChIKey of 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide?
The InChIKey is FLRRRUABWXDBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13(2)12-9(14)10(8-11)6-4-3-5-7-10/h3-7H2,1-2H3,(H,12,14).
What are the key properties of 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide?
1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide has a molecular weight of 195.27 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N',N'-dimethylcyclohexane-1-carbohydrazide is sourced from PubChem (CID 78974832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).