N-(3-methylbutyl)-1,1-diphenylmethanimine

C18H21N — CID 11054109

IUPACN-(3-methylbutyl)-1,1-diphenylmethanimine
SMILESCC(C)CCN=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21N/c1-15(2)13-14-19-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3
InChIKeyAKRNRYUJGSFAAF-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.57
Rot. Bonds5

About N-(3-methylbutyl)-1,1-diphenylmethanimine

N-(3-methylbutyl)-1,1-diphenylmethanimine (PubChem CID 11054109) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(3-methylbutyl)-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-(3-methylbutyl)-1,1-diphenylmethanimine
PubChem CID11054109
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC NameN-(3-methylbutyl)-1,1-diphenylmethanimine
SMILESCC(C)CCN=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21N/c1-15(2)13-14-19-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3
InChIKeyAKRNRYUJGSFAAF-UHFFFAOYSA-N
XLogP4.57
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-(benzhydrylideneamino)propanal
CID 11447740
N-(2,2-dimethoxyethyl)-1,1-diphenylmethanimine
CID 155675021
S-(3-methylbutyl) benzenecarbothioate
CID 23432719
2-(3-methylbutyl)-1-(2-phenylethyl)guanidine
CID 111022873
1,1-diphenyl-N-(4-phenylbutan-2-yl)methan(15N)imine
CID 170780708
2-(benzhydrylideneamino)acetic acid
CID 118304722
2-(benzhydrylideneamino)-4-methylpentanoic acid
CID 87285851
5-(benzhydrylideneamino)hexan-2-one
CID 21343384
6-methyl-1-phenylheptan-1-one
CID 64505975
(E)-N-[bis(2-methylpropyl)boranyl]-4-methyl-1-phenylpentan-1-imine
CID 13129831
18-methyl-1-phenylnonadecan-1-one
CID 141198244
6-methyl-3-phenylhept-2-enoic acid
CID 123162067

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-1,1-diphenylmethanimine?
The IUPAC name of N-(3-methylbutyl)-1,1-diphenylmethanimine (CID 11054109) is N-(3-methylbutyl)-1,1-diphenylmethanimine.
What is the SMILES notation for N-(3-methylbutyl)-1,1-diphenylmethanimine?
The canonical SMILES for N-(3-methylbutyl)-1,1-diphenylmethanimine is CC(C)CCN=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-methylbutyl)-1,1-diphenylmethanimine?
The InChIKey is AKRNRYUJGSFAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-15(2)13-14-19-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3.
What are the key properties of N-(3-methylbutyl)-1,1-diphenylmethanimine?
N-(3-methylbutyl)-1,1-diphenylmethanimine has a molecular weight of 251.37 g/mol, XLogP of 4.57, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-1,1-diphenylmethanimine is sourced from PubChem (CID 11054109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).