N-decyl-1-(4-phenylphenyl)methanimine

C23H31N — CID 86187503

IUPACN-decyl-1-(4-phenylphenyl)methanimine
SMILESCCCCCCCCCC/N=C/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H31N/c1-2-3-4-5-6-7-8-12-19-24-20-21-15-17-23(18-16-21)22-13-10-9-11-14-22/h9-11,13-18,20H,2-8,12,19H2,1H3/b24-20+
InChIKeyIUJZBDFXEODCHU-HIXSDJFHSA-N
MW321.51 g/mol
LogP6.91
Rot. Bonds11

About N-decyl-1-(4-phenylphenyl)methanimine

N-decyl-1-(4-phenylphenyl)methanimine (PubChem CID 86187503) has the molecular formula C23H31N and a molecular weight of 321.51 g/mol. Its IUPAC name is N-decyl-1-(4-phenylphenyl)methanimine.

Molecular Properties

Compound NameN-decyl-1-(4-phenylphenyl)methanimine
PubChem CID86187503
Molecular FormulaC23H31N
Molecular Weight321.51 g/mol
Exact Mass321.25
IUPAC NameN-decyl-1-(4-phenylphenyl)methanimine
SMILESCCCCCCCCCC/N=C/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H31N/c1-2-3-4-5-6-7-8-12-19-24-20-21-15-17-23(18-16-21)22-13-10-9-11-14-22/h9-11,13-18,20H,2-8,12,19H2,1H3/b24-20+
InChIKeyIUJZBDFXEODCHU-HIXSDJFHSA-N
XLogP6.91
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.51
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-decyl-1-[4-(decyliminomethyl)phenyl]methanimine
CID 101093995
1-(4-methylphenyl)-N-nonylmethanimine
CID 525728
4-(hexyliminomethyl)benzaldehyde
CID 87557780
1-(4-bromophenyl)-N-decylmethanimine
CID 525668
1-(4-ethenylphenyl)-N-hexylmethanimine
CID 66742447
N-hexyl-1-naphthalen-2-ylmethanimine
CID 10857572
N-hexadecyl-1-(4-methoxyphenyl)methanimine
CID 102417152
4-(decyliminomethyl)-N,N-dimethylaniline
CID 160905349
3-(benzylideneamino)propyl-hexadecyl-dimethylazanium
CID 175686029
1,1'-biphenyl;hexadecane
CID 173308514
N-hexyl-1-(4-prop-1-en-2-ylphenyl)methanimine
CID 90407063
1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-octylmethanimine
CID 3249432

Frequently Asked Questions

What is the IUPAC name of N-decyl-1-(4-phenylphenyl)methanimine?
The IUPAC name of N-decyl-1-(4-phenylphenyl)methanimine (CID 86187503) is N-decyl-1-(4-phenylphenyl)methanimine.
What is the SMILES notation for N-decyl-1-(4-phenylphenyl)methanimine?
The canonical SMILES for N-decyl-1-(4-phenylphenyl)methanimine is CCCCCCCCCC/N=C/c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-decyl-1-(4-phenylphenyl)methanimine?
The InChIKey is IUJZBDFXEODCHU-HIXSDJFHSA-N. The full InChI is InChI=1S/C23H31N/c1-2-3-4-5-6-7-8-12-19-24-20-21-15-17-23(18-16-21)22-13-10-9-11-14-22/h9-11,13-18,20H,2-8,12,19H2,1H3/b24-20+.
What are the key properties of N-decyl-1-(4-phenylphenyl)methanimine?
N-decyl-1-(4-phenylphenyl)methanimine has a molecular weight of 321.51 g/mol, XLogP of 6.91, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-1-(4-phenylphenyl)methanimine is sourced from PubChem (CID 86187503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).