N'-(1-methylcyclohexyl)methanimidamide

C8H16N2 — CID 174272573

IUPACN'-(1-methylcyclohexyl)methanimidamide
SMILESCC1(/N=C/N)CCCCC1
InChIInChI=1S/C8H16N2/c1-8(10-7-9)5-3-2-4-6-8/h7H,2-6H2,1H3,(H2,9,10)
InChIKeyFVWKPKZNTKBRMV-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.70
Rot. Bonds1

About N'-(1-methylcyclohexyl)methanimidamide

N'-(1-methylcyclohexyl)methanimidamide (PubChem CID 174272573) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N'-(1-methylcyclohexyl)methanimidamide.

Molecular Properties

Compound NameN'-(1-methylcyclohexyl)methanimidamide
PubChem CID174272573
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN'-(1-methylcyclohexyl)methanimidamide
SMILESCC1(/N=C/N)CCCCC1
InChIInChI=1S/C8H16N2/c1-8(10-7-9)5-3-2-4-6-8/h7H,2-6H2,1H3,(H2,9,10)
InChIKeyFVWKPKZNTKBRMV-UHFFFAOYSA-N
XLogP1.70
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(1-methylcyclohexyl)methanimidamide?
The IUPAC name of N'-(1-methylcyclohexyl)methanimidamide (CID 174272573) is N'-(1-methylcyclohexyl)methanimidamide.
What is the SMILES notation for N'-(1-methylcyclohexyl)methanimidamide?
The canonical SMILES for N'-(1-methylcyclohexyl)methanimidamide is CC1(/N=C/N)CCCCC1.
What is the InChIKey of N'-(1-methylcyclohexyl)methanimidamide?
The InChIKey is FVWKPKZNTKBRMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-8(10-7-9)5-3-2-4-6-8/h7H,2-6H2,1H3,(H2,9,10).
What are the key properties of N'-(1-methylcyclohexyl)methanimidamide?
N'-(1-methylcyclohexyl)methanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-methylcyclohexyl)methanimidamide is sourced from PubChem (CID 174272573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).