N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine

C17H19N — CID 12733574

IUPACN-(2-methyl-1-phenylpropyl)-1-phenylmethanimine
SMILESCC(C)C(/N=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-14(2)17(16-11-7-4-8-12-16)18-13-15-9-5-3-6-10-15/h3-14,17H,1-2H3/b18-13+
InChIKeyDTLIBWLYMXZSQE-QGOAFFKASA-N
MW237.35 g/mol
LogP4.50
Rot. Bonds4

About N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine

N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine (PubChem CID 12733574) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine.

Molecular Properties

Compound NameN-(2-methyl-1-phenylpropyl)-1-phenylmethanimine
PubChem CID12733574
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC NameN-(2-methyl-1-phenylpropyl)-1-phenylmethanimine
SMILESCC(C)C(/N=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-14(2)17(16-11-7-4-8-12-16)18-13-15-9-5-3-6-10-15/h3-14,17H,1-2H3/b18-13+
InChIKeyDTLIBWLYMXZSQE-QGOAFFKASA-N
XLogP4.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2R,3R)-3-(benzylideneamino)butan-2-yl]-1-phenylmethanimine
CID 929328
1-(benzylideneamino)ethanol
CID 66697160
N-[bis(trimethylsilyl)methyl]-1-phenylmethanimine
CID 71344888
1-(4-methoxyphenyl)-N-[(1S)-1-phenylethyl]methanimine
CID 778491
2-[[1-[(2-hydroxyphenyl)methylideneamino]-1-phenylpropan-2-yl]iminomethyl]phenol
CID 154704907
3-(benzylideneamino)butan-1-ol
CID 101452219
2-[1-[(4-fluorophenyl)methylideneamino]-2-methylpropyl]aniline
CID 139982409
(1R,2R)-2-[(4-methylphenyl)methylideneamino]-1-phenylpropan-1-ol
CID 101116812
N-[1-(5-methylfuran-2-yl)ethyl]-1-phenylmethanimine
CID 21037717
ethane;N-methyl-1-phenylmethanimine
CID 90887000
(E)-1-(4-chlorophenyl)-N-[[(E)-(4-chlorophenyl)methylideneamino]-phenylmethyl]methanimine
CID 24721019
1-[4-(4-methoxyphenyl)phenyl]-N-[(1S)-1-phenylethyl]methanimine
CID 101125000

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine?
The IUPAC name of N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine (CID 12733574) is N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine.
What is the SMILES notation for N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine?
The canonical SMILES for N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine is CC(C)C(/N=C/c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine?
The InChIKey is DTLIBWLYMXZSQE-QGOAFFKASA-N. The full InChI is InChI=1S/C17H19N/c1-14(2)17(16-11-7-4-8-12-16)18-13-15-9-5-3-6-10-15/h3-14,17H,1-2H3/b18-13+.
What are the key properties of N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine?
N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine has a molecular weight of 237.35 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylpropyl)-1-phenylmethanimine is sourced from PubChem (CID 12733574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).