1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine

C13H20N2O — CID 103575175

IUPAC1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine
SMILESCOc1ccccc1CN1CC(C)C(N)C1
InChIInChI=1S/C13H20N2O/c1-10-7-15(9-12(10)14)8-11-5-3-4-6-13(11)16-2/h3-6,10,12H,7-9,14H2,1-2H3
InChIKeySAIWFTUXXCNRSF-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.47
Rot. Bonds3

About 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine

1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine (PubChem CID 103575175) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine
PubChem CID103575175
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine
SMILESCOc1ccccc1CN1CC(C)C(N)C1
InChIInChI=1S/C13H20N2O/c1-10-7-15(9-12(10)14)8-11-5-3-4-6-13(11)16-2/h3-6,10,12H,7-9,14H2,1-2H3
InChIKeySAIWFTUXXCNRSF-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-methoxy-2-propan-2-yloxyphenyl)methyl]-4-methylpyrrolidin-3-amine;hydrochloride
CID 120908867
(3S,4R)-1-[(2-methoxyphenyl)methyl]-4-phenylpyrrolidin-3-amine
CID 120770365
1-[(2-bromophenyl)methyl]-4-methylpyrrolidin-3-amine
CID 103575185
(2S,6S)-4-[(2-methoxyphenyl)methyl]-2,6-dimethylmorpholine
CID 6937591
1-[(2-methoxyphenyl)methyl]-3,5-dimethylpiperazine
CID 63863865
1-[(3-bromo-2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine
CID 120909295
1-[(2-methoxyphenyl)methyl]piperidin-4-amine
CID 70277411
4-methyl-1-[[2-(pyridin-3-ylmethoxy)phenyl]methyl]pyrrolidin-3-amine;hydrochloride
CID 120909460
(3R)-1-[(2-methoxyphenyl)methyl]-3-methylpiperazine
CID 95443854
1-[(2-chloro-5-fluorophenyl)methyl]-4-methylpyrrolidin-3-amine
CID 103576941
3-[(2-methoxyphenyl)methyl]-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 115009462
3-benzhydryl-1-[(2-methoxyphenyl)methyl]piperidin-4-amine
CID 69056339

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine?
The IUPAC name of 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine (CID 103575175) is 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine?
The canonical SMILES for 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine is COc1ccccc1CN1CC(C)C(N)C1.
What is the InChIKey of 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine?
The InChIKey is SAIWFTUXXCNRSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-7-15(9-12(10)14)8-11-5-3-4-6-13(11)16-2/h3-6,10,12H,7-9,14H2,1-2H3.
What are the key properties of 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine?
1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methoxyphenyl)methyl]-4-methylpyrrolidin-3-amine is sourced from PubChem (CID 103575175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).