methanimine;(1-methylcyclopropyl)benzene

C11H15N — CID 163372964

IUPACmethanimine;(1-methylcyclopropyl)benzene
SMILESCC1(c2ccccc2)CC1.[H]N=C
InChIInChI=1S/C10H12.CH3N/c1-10(7-8-10)9-5-3-2-4-6-9;1-2/h2-6H,7-8H2,1H3;2H,1H2
InChIKeyVSPDLSMQNZBDFF-UHFFFAOYSA-N
MW161.25 g/mol
LogP3.00
Rot. Bonds1

About methanimine;(1-methylcyclopropyl)benzene

methanimine;(1-methylcyclopropyl)benzene (PubChem CID 163372964) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is methanimine;(1-methylcyclopropyl)benzene.

Molecular Properties

Compound Namemethanimine;(1-methylcyclopropyl)benzene
PubChem CID163372964
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Namemethanimine;(1-methylcyclopropyl)benzene
SMILESCC1(c2ccccc2)CC1.[H]N=C
InChIInChI=1S/C10H12.CH3N/c1-10(7-8-10)9-5-3-2-4-6-9;1-2/h2-6H,7-8H2,1H3;2H,1H2
InChIKeyVSPDLSMQNZBDFF-UHFFFAOYSA-N
XLogP3.00
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methane;(1-methylcyclopentyl)benzene
CID 143499824
ethane;4-methyl-4-phenylpiperidine
CID 91476557
isocyanic acid;(1-methylcyclohexyl)benzene
CID 88703439
4-methyl-4-phenyl-1-prop-1-en-2-ylpiperidine
CID 145156044
(1-methyl-4-phenylcyclohexyl)benzene
CID 164683262
6-methyl-6-phenyl-4-azaspiro[2.5]octane
CID 105453919
1-ethyl-4-methyl-4-phenylpiperidine
CID 70451148
4-methyl-4-phenylazepane
CID 89410025
3-methyl-3-phenylpyrrolidine
CID 21098616
3-methyl-1,3,5-triphenylbicyclo[3.3.1]nonane
CID 142961380
(E)-2-methyl-1-(4-methyl-4-phenylpiperidin-1-yl)but-2-en-1-one
CID 174192675
1-(1-methylcyclopropyl)-4-prop-1-en-2-ylbenzene
CID 145094183

Frequently Asked Questions

What is the IUPAC name of methanimine;(1-methylcyclopropyl)benzene?
The IUPAC name of methanimine;(1-methylcyclopropyl)benzene (CID 163372964) is methanimine;(1-methylcyclopropyl)benzene.
What is the SMILES notation for methanimine;(1-methylcyclopropyl)benzene?
The canonical SMILES for methanimine;(1-methylcyclopropyl)benzene is CC1(c2ccccc2)CC1.[H]N=C.
What is the InChIKey of methanimine;(1-methylcyclopropyl)benzene?
The InChIKey is VSPDLSMQNZBDFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12.CH3N/c1-10(7-8-10)9-5-3-2-4-6-9;1-2/h2-6H,7-8H2,1H3;2H,1H2.
What are the key properties of methanimine;(1-methylcyclopropyl)benzene?
methanimine;(1-methylcyclopropyl)benzene has a molecular weight of 161.25 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanimine;(1-methylcyclopropyl)benzene is sourced from PubChem (CID 163372964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).