N-(2-methoxyphenyl)methanimine;pyrrolidine

C12H18N2O — CID 174894102

IUPACN-(2-methoxyphenyl)methanimine;pyrrolidine
SMILESC1CCNC1.C=Nc1ccccc1OC
InChIInChI=1S/C8H9NO.C4H9N/c1-9-7-5-3-4-6-8(7)10-2;1-2-4-5-3-1/h3-6H,1H2,2H3;5H,1-4H2
InChIKeyCYANPCSORRFHQH-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.40
Rot. Bonds2

About N-(2-methoxyphenyl)methanimine;pyrrolidine

N-(2-methoxyphenyl)methanimine;pyrrolidine (PubChem CID 174894102) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-(2-methoxyphenyl)methanimine;pyrrolidine.

Molecular Properties

Compound NameN-(2-methoxyphenyl)methanimine;pyrrolidine
PubChem CID174894102
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-(2-methoxyphenyl)methanimine;pyrrolidine
SMILESC1CCNC1.C=Nc1ccccc1OC
InChIInChI=1S/C8H9NO.C4H9N/c1-9-7-5-3-4-6-8(7)10-2;1-2-4-5-3-1/h3-6H,1H2,2H3;5H,1-4H2
InChIKeyCYANPCSORRFHQH-UHFFFAOYSA-N
XLogP2.40
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-fluoro-3-methoxyphenyl)methanimine
CID 170584853
bis(2-methoxyphenyl)diazene
CID 11947
1-[1-(2-methoxyphenyl)ethyl]-1,4-diazepane
CID 3722689
4-(2-methoxyphenyl)piperidine
CID 544738
N-[2-(chloromethoxy)phenyl]methanimine
CID 143973444
1-methoxy-2-(sulfinylamino)benzene
CID 598052
3-[(2-methoxyphenyl)methyl]piperidine
CID 5005916
2-(1,4-diazepan-1-yl)-3-(2-methoxyphenyl)-2-methylpropanenitrile
CID 61005584
azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
1-(1,4-diazepan-1-yl)-3-(2-methoxyphenyl)propan-1-one
CID 82090865
1-[bis(2-methoxyphenyl)methyl]piperazine
CID 5183937

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)methanimine;pyrrolidine?
The IUPAC name of N-(2-methoxyphenyl)methanimine;pyrrolidine (CID 174894102) is N-(2-methoxyphenyl)methanimine;pyrrolidine.
What is the SMILES notation for N-(2-methoxyphenyl)methanimine;pyrrolidine?
The canonical SMILES for N-(2-methoxyphenyl)methanimine;pyrrolidine is C1CCNC1.C=Nc1ccccc1OC.
What is the InChIKey of N-(2-methoxyphenyl)methanimine;pyrrolidine?
The InChIKey is CYANPCSORRFHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO.C4H9N/c1-9-7-5-3-4-6-8(7)10-2;1-2-4-5-3-1/h3-6H,1H2,2H3;5H,1-4H2.
What are the key properties of N-(2-methoxyphenyl)methanimine;pyrrolidine?
N-(2-methoxyphenyl)methanimine;pyrrolidine has a molecular weight of 206.29 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)methanimine;pyrrolidine is sourced from PubChem (CID 174894102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).