N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine

C13H19N — CID 169144037

IUPACN-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine
SMILESC/C=N/c1cc(C)c(C(C)C)cc1C
InChIInChI=1S/C13H19N/c1-6-14-13-8-10(4)12(9(2)3)7-11(13)5/h6-9H,1-5H3/b14-6+
InChIKeyATSKIEMTLNXMRG-MKMNVTDBSA-N
MW189.30 g/mol
LogP4.15
Rot. Bonds2

About N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine

N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine (PubChem CID 169144037) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine.

Molecular Properties

Compound NameN-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine
PubChem CID169144037
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine
SMILESC/C=N/c1cc(C)c(C(C)C)cc1C
InChIInChI=1S/C13H19N/c1-6-14-13-8-10(4)12(9(2)3)7-11(13)5/h6-9H,1-5H3/b14-6+
InChIKeyATSKIEMTLNXMRG-MKMNVTDBSA-N
XLogP4.15
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 54.15
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-(ethylideneamino)-2,5-dimethylbenzaldehyde
CID 163372470
1-(2,4-dimethyl-5-propan-2-ylphenyl)-2,4-dimethyl-5-propan-2-ylbenzene
CID 144517655
9,9-bis(2,5-dimethyl-4-propan-2-ylphenyl)-2,7-dimethylfluorene
CID 160898108
1-(1-iodoethyl)-2,4,5-trimethylbenzene
CID 142348913
1,5-dimethyl-2-methylsulfonyl-4-propan-2-ylbenzene
CID 123989601
1-ethyl-5-methyl-2,4-di(propan-2-yl)benzene
CID 18711823
4-[(4-fluorophenyl)methylideneamino]-5-methyl-2-propan-2-ylphenol
CID 71520132
6-(ethylideneamino)-7-methyl-1H-quinazoline-2,4-dione
CID 134360357
N-[4-[3-(4-fluorophenyl)prop-1-en-2-yl]-2,5-dimethylphenyl]ethanimine
CID 167080179
N-(3,4,5-trimethylphenyl)ethanimine
CID 129224731
1-tert-butyl-5-(2,4-dimethyl-5-propan-2-ylphenyl)-2,4-dimethylbenzene
CID 144517673
CID 58229828
CID 58229828

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine?
The IUPAC name of N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine (CID 169144037) is N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine.
What is the SMILES notation for N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine?
The canonical SMILES for N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine is C/C=N/c1cc(C)c(C(C)C)cc1C.
What is the InChIKey of N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine?
The InChIKey is ATSKIEMTLNXMRG-MKMNVTDBSA-N. The full InChI is InChI=1S/C13H19N/c1-6-14-13-8-10(4)12(9(2)3)7-11(13)5/h6-9H,1-5H3/b14-6+.
What are the key properties of N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine?
N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine has a molecular weight of 189.30 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethyl-4-propan-2-ylphenyl)ethanimine is sourced from PubChem (CID 169144037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).