(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine

C11H21NO — CID 143498332

IUPAC(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine
SMILESCO/N=C(/C)CC1CCC(C)CC1
InChIInChI=1S/C11H21NO/c1-9-4-6-11(7-5-9)8-10(2)12-13-3/h9,11H,4-8H2,1-3H3/b12-10-
InChIKeyYEJOJSOCPNPWME-BENRWUELSA-N
MW183.30 g/mol
LogP3.23
Rot. Bonds3

About (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine

(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine (PubChem CID 143498332) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine.

Molecular Properties

Compound Name(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine
PubChem CID143498332
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC Name(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine
SMILESCO/N=C(/C)CC1CCC(C)CC1
InChIInChI=1S/C11H21NO/c1-9-4-6-11(7-5-9)8-10(2)12-13-3/h9,11H,4-8H2,1-3H3/b12-10-
InChIKeyYEJOJSOCPNPWME-BENRWUELSA-N
XLogP3.23
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine?
The IUPAC name of (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine (CID 143498332) is (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine.
What is the SMILES notation for (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine?
The canonical SMILES for (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine is CO/N=C(/C)CC1CCC(C)CC1.
What is the InChIKey of (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine?
The InChIKey is YEJOJSOCPNPWME-BENRWUELSA-N. The full InChI is InChI=1S/C11H21NO/c1-9-4-6-11(7-5-9)8-10(2)12-13-3/h9,11H,4-8H2,1-3H3/b12-10-.
What are the key properties of (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine?
(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine has a molecular weight of 183.30 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine is sourced from PubChem (CID 143498332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).