[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol

C12H17NO2 — CID 115103415

IUPAC[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol
SMILESCOc1ccccc1C1(CO)CCCN1
InChIInChI=1S/C12H17NO2/c1-15-11-6-3-2-5-10(11)12(9-14)7-4-8-13-12/h2-3,5-6,13-14H,4,7-9H2,1H3
InChIKeyKEEIYYKTNUHCQT-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.27
Rot. Bonds3

About [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol

[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol (PubChem CID 115103415) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol
PubChem CID115103415
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol
SMILESCOc1ccccc1C1(CO)CCCN1
InChIInChI=1S/C12H17NO2/c1-15-11-6-3-2-5-10(11)12(9-14)7-4-8-13-12/h2-3,5-6,13-14H,4,7-9H2,1H3
InChIKeyKEEIYYKTNUHCQT-UHFFFAOYSA-N
XLogP1.27
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenyl)pyrrolidine-2-carboxylic acid
CID 70486714
[1-(2-methoxyphenyl)cyclopentyl]methanol
CID 83687614
2-(2-methoxyphenyl)-2-propylazetidine
CID 115058535
2-(2,6-dimethoxyphenyl)-2-methylpyrrolidine
CID 116810545
2-[2-(2-methoxyethoxy)phenyl]-2-propylpyrrolidine
CID 104660354
2-[2-(fluoromethyl)-3-methoxyphenyl]-2-methylpyrrolidine
CID 117320275
2-(3-methoxy-2-methylsulfanylphenyl)-2-methylpyrrolidine
CID 117347870
2-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
CID 66466669
2-(2-chlorophenyl)-2-(methoxymethyl)pyrrolidine
CID 117271928
2-[2-(aminomethyl)pyrrolidin-2-yl]phenol
CID 115059279
2-(2,4-dimethoxyphenyl)-2-propylpyrrolidine
CID 66465346
2-ethyl-2-[2-(trifluoromethoxy)phenyl]azepane
CID 79119088

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol (CID 115103415) is [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol is COc1ccccc1C1(CO)CCCN1.
What is the InChIKey of [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol?
The InChIKey is KEEIYYKTNUHCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-15-11-6-3-2-5-10(11)12(9-14)7-4-8-13-12/h2-3,5-6,13-14H,4,7-9H2,1H3.
What are the key properties of [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol?
[2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol has a molecular weight of 207.27 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 115103415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).