N-(3-ethyl-3-methylhexyl)methanimine

C10H21N — CID 174298399

IUPACN-(3-ethyl-3-methylhexyl)methanimine
SMILESC=NCCC(C)(CC)CCC
InChIInChI=1S/C10H21N/c1-5-7-10(3,6-2)8-9-11-4/h4-9H2,1-3H3
InChIKeyRKWZLIBBDWVACL-UHFFFAOYSA-N
MW155.28 g/mol
LogP3.29
Rot. Bonds6

About N-(3-ethyl-3-methylhexyl)methanimine

N-(3-ethyl-3-methylhexyl)methanimine (PubChem CID 174298399) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N-(3-ethyl-3-methylhexyl)methanimine.

Molecular Properties

Compound NameN-(3-ethyl-3-methylhexyl)methanimine
PubChem CID174298399
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN-(3-ethyl-3-methylhexyl)methanimine
SMILESC=NCCC(C)(CC)CCC
InChIInChI=1S/C10H21N/c1-5-7-10(3,6-2)8-9-11-4/h4-9H2,1-3H3
InChIKeyRKWZLIBBDWVACL-UHFFFAOYSA-N
XLogP3.29
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 ≤ 53.29
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-methylheptane;2-methylprop-1-ene
CID 170590523
4-ethyl-4-methyloctane;propane
CID 176660925
ethane;4-ethyl-4-methylnonane
CID 164538733
3-(iodomethyl)-3-methylhexane
CID 121290697
N-(3-ethyl-4,4-dimethyl-3-methylsulfanylpentyl)methanimine
CID 134559304
N,3-diethyl-3-methylhexan-1-amine
CID 163633802
2-methyl-2-[(methylideneamino)methyl]butan-1-amine
CID 163789947
4-ethyl-4-methyloctane;isocyanic acid
CID 87136372
ethene;(3S)-5-ethyl-3,5-dimethyloctane;propane
CID 143713458
(3S)-5-ethyl-3,5-dimethyloctane
CID 143713459
ethane;3-ethyl-3-methylhexanenitrile
CID 145394451
5-ethyl-5-methylundecane
CID 57491570

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-3-methylhexyl)methanimine?
The IUPAC name of N-(3-ethyl-3-methylhexyl)methanimine (CID 174298399) is N-(3-ethyl-3-methylhexyl)methanimine.
What is the SMILES notation for N-(3-ethyl-3-methylhexyl)methanimine?
The canonical SMILES for N-(3-ethyl-3-methylhexyl)methanimine is C=NCCC(C)(CC)CCC.
What is the InChIKey of N-(3-ethyl-3-methylhexyl)methanimine?
The InChIKey is RKWZLIBBDWVACL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-5-7-10(3,6-2)8-9-11-4/h4-9H2,1-3H3.
What are the key properties of N-(3-ethyl-3-methylhexyl)methanimine?
N-(3-ethyl-3-methylhexyl)methanimine has a molecular weight of 155.28 g/mol, XLogP of 3.29, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-3-methylhexyl)methanimine is sourced from PubChem (CID 174298399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).