N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine

C19H21N — CID 91735663

IUPACN-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine
SMILESCC(C)c1ccc(/C=N/c2ccccc2C2CC2)cc1
InChIInChI=1S/C19H21N/c1-14(2)16-9-7-15(8-10-16)13-20-19-6-4-3-5-18(19)17-11-12-17/h3-10,13-14,17H,11-12H2,1-2H3/b20-13+
InChIKeyDUCYODWSOCMOBU-DEDYPNTBSA-N
MW263.38 g/mol
LogP5.44
Rot. Bonds4

About N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine

N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine (PubChem CID 91735663) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine.

Molecular Properties

Compound NameN-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine
PubChem CID91735663
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC NameN-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine
SMILESCC(C)c1ccc(/C=N/c2ccccc2C2CC2)cc1
InChIInChI=1S/C19H21N/c1-14(2)16-9-7-15(8-10-16)13-20-19-6-4-3-5-18(19)17-11-12-17/h3-10,13-14,17H,11-12H2,1-2H3/b20-13+
InChIKeyDUCYODWSOCMOBU-DEDYPNTBSA-N
XLogP5.44
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.38
LogP ≤ 55.44
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 N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine?
The IUPAC name of N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine (CID 91735663) is N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine.
What is the SMILES notation for N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine?
The canonical SMILES for N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine is CC(C)c1ccc(/C=N/c2ccccc2C2CC2)cc1.
What is the InChIKey of N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine?
The InChIKey is DUCYODWSOCMOBU-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H21N/c1-14(2)16-9-7-15(8-10-16)13-20-19-6-4-3-5-18(19)17-11-12-17/h3-10,13-14,17H,11-12H2,1-2H3/b20-13+.
What are the key properties of N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine?
N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine has a molecular weight of 263.38 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylphenyl)-1-(4-propan-2-ylphenyl)methanimine is sourced from PubChem (CID 91735663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).