(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine

C15H27NO — CID 82838946

IUPAC(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine
SMILESCNC/C(=C\C1CCC(C)O1)C1CCCCC1
InChIInChI=1S/C15H27NO/c1-12-8-9-15(17-12)10-14(11-16-2)13-6-4-3-5-7-13/h10,12-13,15-16H,3-9,11H2,1-2H3/b14-10+
InChIKeyFTLWADAZASXGKP-GXDHUFHOSA-N
MW237.39 g/mol
LogP3.28
Rot. Bonds4

About (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine

(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine (PubChem CID 82838946) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine
PubChem CID82838946
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine
SMILESCNC/C(=C\C1CCC(C)O1)C1CCCCC1
InChIInChI=1S/C15H27NO/c1-12-8-9-15(17-12)10-14(11-16-2)13-6-4-3-5-7-13/h10,12-13,15-16H,3-9,11H2,1-2H3/b14-10+
InChIKeyFTLWADAZASXGKP-GXDHUFHOSA-N
XLogP3.28
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine?
The IUPAC name of (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine (CID 82838946) is (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine.
What is the SMILES notation for (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine?
The canonical SMILES for (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine is CNC/C(=C\C1CCC(C)O1)C1CCCCC1.
What is the InChIKey of (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine?
The InChIKey is FTLWADAZASXGKP-GXDHUFHOSA-N. The full InChI is InChI=1S/C15H27NO/c1-12-8-9-15(17-12)10-14(11-16-2)13-6-4-3-5-7-13/h10,12-13,15-16H,3-9,11H2,1-2H3/b14-10+.
What are the key properties of (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine?
(Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine has a molecular weight of 237.39 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-cyclohexyl-N-methyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine is sourced from PubChem (CID 82838946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).