(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine

C18H24N2 — CID 142058733

IUPAC(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine
SMILESCC/C=C1/CCCC/C1=N\C1=NC2=CCCC=C2C1C
InChIInChI=1S/C18H24N2/c1-3-8-14-9-4-6-11-16(14)19-18-13(2)15-10-5-7-12-17(15)20-18/h8,10,12-13H,3-7,9,11H2,1-2H3/b14-8-,19-16+
InChIKeyDPOZCEJQURFDGL-UOWSXMIYSA-N
MW268.40 g/mol
LogP4.99
Rot. Bonds1

About (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine

(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine (PubChem CID 142058733) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine.

Molecular Properties

Compound Name(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine
PubChem CID142058733
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine
SMILESCC/C=C1/CCCC/C1=N\C1=NC2=CCCC=C2C1C
InChIInChI=1S/C18H24N2/c1-3-8-14-9-4-6-11-16(14)19-18-13(2)15-10-5-7-12-17(15)20-18/h8,10,12-13H,3-7,9,11H2,1-2H3/b14-8-,19-16+
InChIKeyDPOZCEJQURFDGL-UOWSXMIYSA-N
XLogP4.99
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine?
The IUPAC name of (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine (CID 142058733) is (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine.
What is the SMILES notation for (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine?
The canonical SMILES for (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine is CC/C=C1/CCCC/C1=N\C1=NC2=CCCC=C2C1C.
What is the InChIKey of (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine?
The InChIKey is DPOZCEJQURFDGL-UOWSXMIYSA-N. The full InChI is InChI=1S/C18H24N2/c1-3-8-14-9-4-6-11-16(14)19-18-13(2)15-10-5-7-12-17(15)20-18/h8,10,12-13H,3-7,9,11H2,1-2H3/b14-8-,19-16+.
What are the key properties of (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine?
(2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine has a molecular weight of 268.40 g/mol, XLogP of 4.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(3-methyl-5,6-dihydro-3H-indol-2-yl)-2-propylidenecyclohexan-1-imine is sourced from PubChem (CID 142058733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).