N-(benzhydrylideneamino)cyclohexen-1-amine

C19H20N2 — CID 2343356

IUPACN-(benzhydrylideneamino)cyclohexen-1-amine
SMILESC1=C(NN=C(c2ccccc2)c2ccccc2)CCCC1
InChIInChI=1S/C19H20N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)21-20-18-14-8-3-9-15-18/h1-2,4-7,10-14,20H,3,8-9,15H2
InChIKeyFITGMXSQTHJHTO-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.49
Rot. Bonds4

About N-(benzhydrylideneamino)cyclohexen-1-amine

N-(benzhydrylideneamino)cyclohexen-1-amine (PubChem CID 2343356) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(benzhydrylideneamino)cyclohexen-1-amine.

Molecular Properties

Compound NameN-(benzhydrylideneamino)cyclohexen-1-amine
PubChem CID2343356
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC NameN-(benzhydrylideneamino)cyclohexen-1-amine
SMILESC1=C(NN=C(c2ccccc2)c2ccccc2)CCCC1
InChIInChI=1S/C19H20N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)21-20-18-14-8-3-9-15-18/h1-2,4-7,10-14,20H,3,8-9,15H2
InChIKeyFITGMXSQTHJHTO-UHFFFAOYSA-N
XLogP4.49
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.49
H-Bond Donors ≤ 51
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 N-(benzhydrylideneamino)cyclohexen-1-amine?
The IUPAC name of N-(benzhydrylideneamino)cyclohexen-1-amine (CID 2343356) is N-(benzhydrylideneamino)cyclohexen-1-amine.
What is the SMILES notation for N-(benzhydrylideneamino)cyclohexen-1-amine?
The canonical SMILES for N-(benzhydrylideneamino)cyclohexen-1-amine is C1=C(NN=C(c2ccccc2)c2ccccc2)CCCC1.
What is the InChIKey of N-(benzhydrylideneamino)cyclohexen-1-amine?
The InChIKey is FITGMXSQTHJHTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)21-20-18-14-8-3-9-15-18/h1-2,4-7,10-14,20H,3,8-9,15H2.
What are the key properties of N-(benzhydrylideneamino)cyclohexen-1-amine?
N-(benzhydrylideneamino)cyclohexen-1-amine has a molecular weight of 276.38 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzhydrylideneamino)cyclohexen-1-amine is sourced from PubChem (CID 2343356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).