4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine

C13H19NO — CID 23009519

IUPAC4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
SMILESCOc1ccccc1CC1CNC(C)C1
InChIInChI=1S/C13H19NO/c1-10-7-11(9-14-10)8-12-5-3-4-6-13(12)15-2/h3-6,10-11,14H,7-9H2,1-2H3
InChIKeyCFZUYQMPCUZSOX-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.24
Rot. Bonds3

About 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine

4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine (PubChem CID 23009519) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
PubChem CID23009519
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
SMILESCOc1ccccc1CC1CNC(C)C1
InChIInChI=1S/C13H19NO/c1-10-7-11(9-14-10)8-12-5-3-4-6-13(12)15-2/h3-6,10-11,14H,7-9H2,1-2H3
InChIKeyCFZUYQMPCUZSOX-UHFFFAOYSA-N
XLogP2.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-4-[(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid
CID 70543840
1-(cyclopent-3-en-1-ylmethyl)-2-methoxybenzene
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4-[(3,4-dimethoxyphenyl)methyl]-2-methylpyrrolidine
CID 23009517
3-[(2-methoxyphenyl)methyl]piperidine
CID 5005916
2-methyl-5-[[2-(trifluoromethoxy)phenyl]methyl]piperidine
CID 104823558
1-methoxy-2-[(4-propylcyclohexyl)methyl]benzene
CID 141394597
2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-oxazinane;hydrochloride
CID 117226870
3-[(2-methoxyphenyl)methyl]cyclopentan-1-one
CID 64521537
1-[(2-methoxyphenyl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64846874
(2R)-2-[(2-methoxyphenyl)methyl]morpholine
CID 58689699
(3R)-1-[(2-methoxyphenyl)methyl]-3-methylpiperazine
CID 95443854
1-[(2-methoxyphenyl)methyl]-3,5-dimethylpiperazine
CID 63863865

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine?
The IUPAC name of 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine (CID 23009519) is 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine.
What is the SMILES notation for 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine?
The canonical SMILES for 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine is COc1ccccc1CC1CNC(C)C1.
What is the InChIKey of 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine?
The InChIKey is CFZUYQMPCUZSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-7-11(9-14-10)8-12-5-3-4-6-13(12)15-2/h3-6,10-11,14H,7-9H2,1-2H3.
What are the key properties of 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine?
4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine has a molecular weight of 205.30 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine is sourced from PubChem (CID 23009519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).