N-cyclohexyl-N'-ethyl-N-methylmethanimidamide

C10H20N2 — CID 89134156

IUPACN-cyclohexyl-N'-ethyl-N-methylmethanimidamide
SMILESCC/N=C/N(C)C1CCCCC1
InChIInChI=1S/C10H20N2/c1-3-11-9-12(2)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/b11-9+
InChIKeyXHYWQBDAKNOCIQ-PKNBQFBNSA-N
MW168.28 g/mol
LogP2.30
Rot. Bonds3

About N-cyclohexyl-N'-ethyl-N-methylmethanimidamide

N-cyclohexyl-N'-ethyl-N-methylmethanimidamide (PubChem CID 89134156) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-cyclohexyl-N'-ethyl-N-methylmethanimidamide.

Molecular Properties

Compound NameN-cyclohexyl-N'-ethyl-N-methylmethanimidamide
PubChem CID89134156
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-cyclohexyl-N'-ethyl-N-methylmethanimidamide
SMILESCC/N=C/N(C)C1CCCCC1
InChIInChI=1S/C10H20N2/c1-3-11-9-12(2)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/b11-9+
InChIKeyXHYWQBDAKNOCIQ-PKNBQFBNSA-N
XLogP2.30
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.30
H-Bond Donors ≤ 50
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-cyclohexyl-N'-ethyl-N-methylmethanimidamide?
The IUPAC name of N-cyclohexyl-N'-ethyl-N-methylmethanimidamide (CID 89134156) is N-cyclohexyl-N'-ethyl-N-methylmethanimidamide.
What is the SMILES notation for N-cyclohexyl-N'-ethyl-N-methylmethanimidamide?
The canonical SMILES for N-cyclohexyl-N'-ethyl-N-methylmethanimidamide is CC/N=C/N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N'-ethyl-N-methylmethanimidamide?
The InChIKey is XHYWQBDAKNOCIQ-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-11-9-12(2)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/b11-9+.
What are the key properties of N-cyclohexyl-N'-ethyl-N-methylmethanimidamide?
N-cyclohexyl-N'-ethyl-N-methylmethanimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-ethyl-N-methylmethanimidamide is sourced from PubChem (CID 89134156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).