N-(4-methyloctan-4-yl)methanimine

C10H21N — CID 163935005

IUPACN-(4-methyloctan-4-yl)methanimine
SMILESC=NC(C)(CCC)CCCC
InChIInChI=1S/C10H21N/c1-5-7-9-10(3,11-4)8-6-2/h4-9H2,1-3H3
InChIKeyRLYKETUQFWXULA-UHFFFAOYSA-N
MW155.28 g/mol
LogP3.44
Rot. Bonds6

About N-(4-methyloctan-4-yl)methanimine

N-(4-methyloctan-4-yl)methanimine (PubChem CID 163935005) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N-(4-methyloctan-4-yl)methanimine.

Molecular Properties

Compound NameN-(4-methyloctan-4-yl)methanimine
PubChem CID163935005
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN-(4-methyloctan-4-yl)methanimine
SMILESC=NC(C)(CCC)CCCC
InChIInChI=1S/C10H21N/c1-5-7-9-10(3,11-4)8-6-2/h4-9H2,1-3H3
InChIKeyRLYKETUQFWXULA-UHFFFAOYSA-N
XLogP3.44
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-4,5,5-trimethylnonane
CID 57492041
2,2-dimethylhexane
CID 169424592
2-methyl-1-(methylideneamino)hexan-2-amine
CID 134424167
ethane;2-fluoro-2-methylhexane
CID 142890341
2-hydroxy-2-methylhexanenitrile
CID 10942429
2-ethyl-2-methylhexanenitrile
CID 57197936
azane;2,2-dimethylhexane
CID 161105081
(4R)-4-chloro-4-methyloctane
CID 129374949
(5,6-dibutyl-6-methyldecan-5-yl)azanium hydroxide
CID 87346379
ethyl(2-ethylsilylhexan-2-yl)silane
CID 174897486
4-ethyl-4-methyloctane;propane
CID 176660925
2,2-dimethylhexane;tris(prop-1-ene)
CID 160899116

Frequently Asked Questions

What is the IUPAC name of N-(4-methyloctan-4-yl)methanimine?
The IUPAC name of N-(4-methyloctan-4-yl)methanimine (CID 163935005) is N-(4-methyloctan-4-yl)methanimine.
What is the SMILES notation for N-(4-methyloctan-4-yl)methanimine?
The canonical SMILES for N-(4-methyloctan-4-yl)methanimine is C=NC(C)(CCC)CCCC.
What is the InChIKey of N-(4-methyloctan-4-yl)methanimine?
The InChIKey is RLYKETUQFWXULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-5-7-9-10(3,11-4)8-6-2/h4-9H2,1-3H3.
What are the key properties of N-(4-methyloctan-4-yl)methanimine?
N-(4-methyloctan-4-yl)methanimine has a molecular weight of 155.28 g/mol, XLogP of 3.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyloctan-4-yl)methanimine is sourced from PubChem (CID 163935005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).