ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine

C14H23N — CID 143030207

IUPACethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine
SMILESC=C/C=C1/CC(C)CC/C1=N\C=C.CC
InChIInChI=1S/C12H17N.C2H6/c1-4-6-11-9-10(3)7-8-12(11)13-5-2;1-2/h4-6,10H,1-2,7-9H2,3H3;1-2H3/b11-6-,13-12+;
InChIKeyOTZXSLFNNOAIBC-XGQCCPHISA-N
MW205.34 g/mol
LogP4.53
Rot. Bonds2

About ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine

ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine (PubChem CID 143030207) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine.

Molecular Properties

Compound Nameethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine
PubChem CID143030207
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Nameethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine
SMILESC=C/C=C1/CC(C)CC/C1=N\C=C.CC
InChIInChI=1S/C12H17N.C2H6/c1-4-6-11-9-10(3)7-8-12(11)13-5-2;1-2/h4-6,10H,1-2,7-9H2,3H3;1-2H3/b11-6-,13-12+;
InChIKeyOTZXSLFNNOAIBC-XGQCCPHISA-N
XLogP4.53
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine?
The IUPAC name of ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine (CID 143030207) is ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine.
What is the SMILES notation for ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine?
The canonical SMILES for ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine is C=C/C=C1/CC(C)CC/C1=N\C=C.CC.
What is the InChIKey of ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine?
The InChIKey is OTZXSLFNNOAIBC-XGQCCPHISA-N. The full InChI is InChI=1S/C12H17N.C2H6/c1-4-6-11-9-10(3)7-8-12(11)13-5-2;1-2/h4-6,10H,1-2,7-9H2,3H3;1-2H3/b11-6-,13-12+;.
What are the key properties of ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine?
ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine has a molecular weight of 205.34 g/mol, XLogP of 4.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2Z)-N-ethenyl-4-methyl-2-prop-2-enylidenecyclohexan-1-imine is sourced from PubChem (CID 143030207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).