N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine

C13H19N — CID 123174070

IUPACN-(2-methyl-6-propan-2-ylphenyl)propan-2-imine
SMILESCC(C)=Nc1c(C)cccc1C(C)C
InChIInChI=1S/C13H19N/c1-9(2)12-8-6-7-11(5)13(12)14-10(3)4/h6-9H,1-5H3
InChIKeyHXYFBWMATZYKBH-UHFFFAOYSA-N
MW189.30 g/mol
LogP4.23
Rot. Bonds2

About N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine

N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine (PubChem CID 123174070) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine.

Molecular Properties

Compound NameN-(2-methyl-6-propan-2-ylphenyl)propan-2-imine
PubChem CID123174070
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-(2-methyl-6-propan-2-ylphenyl)propan-2-imine
SMILESCC(C)=Nc1c(C)cccc1C(C)C
InChIInChI=1S/C13H19N/c1-9(2)12-8-6-7-11(5)13(12)14-10(3)4/h6-9H,1-5H3
InChIKeyHXYFBWMATZYKBH-UHFFFAOYSA-N
XLogP4.23
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 ≤ 54.23
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

cobalt;1-[6-[C-methyl-N-(2-methyl-6-propan-2-ylphenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-6-propan-2-ylphenyl)ethanimine
CID 87859497
1-[2-[C-methyl-N-(2-methyl-6-propan-2-ylphenyl)carbonimidoyl]-3-pyridinyl]-N-(2-methyl-6-propan-2-ylphenyl)ethanimine
CID 141216840
2-methyl-N-[(Z)-4-(2-methyl-6-propan-2-ylphenyl)iminopent-2-en-2-yl]-6-propan-2-ylaniline
CID 101126797
N'-[2,6-di(propan-2-yl)phenyl]-N-(2-methyl-6-propan-2-ylphenyl)methanediimine
CID 20719131
2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine;carbanide;nickel monohydride
CID 59870067
N-[2,6-di(propan-2-yl)phenyl]ethanimidoyl bromide
CID 132938731
bis(2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine);(Z)-but-2-ene-2,3-diolate;nickel
CID 139170937
bis(2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine);nickel;toluene
CID 139138147
ethyl N-[2,6-di(propan-2-yl)phenyl]ethanimidate
CID 139084602
1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]-N-(2-methoxy-6-methylphenyl)ethanimine
CID 102457865
CID 102466319
CID 102466319
bis(dibromopalladium);3-N-[2,6-di(propan-2-yl)phenyl]-2-N-[4-[3-[2,6-di(propan-2-yl)phenyl]iminobutan-2-ylideneamino]-2,3,5,6-tetramethylphenyl]butane-2,3-diimine
CID 20750698

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine?
The IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine (CID 123174070) is N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine.
What is the SMILES notation for N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine?
The canonical SMILES for N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine is CC(C)=Nc1c(C)cccc1C(C)C.
What is the InChIKey of N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine?
The InChIKey is HXYFBWMATZYKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-9(2)12-8-6-7-11(5)13(12)14-10(3)4/h6-9H,1-5H3.
What are the key properties of N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine?
N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine has a molecular weight of 189.30 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine is sourced from PubChem (CID 123174070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).