(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol

C13H15NO2 — CID 97293101

IUPAC(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol
SMILESCOc1cccc([C@@H](O)c2cccn2C)c1
InChIInChI=1S/C13H15NO2/c1-14-8-4-7-12(14)13(15)10-5-3-6-11(9-10)16-2/h3-9,13,15H,1-2H3/t13-/m1/s1
InChIKeyYBNQSZFGNRMCPW-CYBMUJFWSA-N
MW217.27 g/mol
LogP2.12
Rot. Bonds3

About (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol

(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol (PubChem CID 97293101) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol.

Molecular Properties

Compound Name(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol
PubChem CID97293101
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol
SMILESCOc1cccc([C@@H](O)c2cccn2C)c1
InChIInChI=1S/C13H15NO2/c1-14-8-4-7-12(14)13(15)10-5-3-6-11(9-10)16-2/h3-9,13,15H,1-2H3/t13-/m1/s1
InChIKeyYBNQSZFGNRMCPW-CYBMUJFWSA-N
XLogP2.12
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(S)-(2,4-dimethoxyphenyl)-(1-methylpyrrol-2-yl)methanol
CID 97293057
(1R)-1-(3-methoxyphenyl)ethanol
CID 10219539
(R)-(3,5-dimethylphenyl)-(1-methylpyrrol-2-yl)methanol
CID 97293069
(S)-(4-chlorophenyl)-(3-methoxyphenyl)methanol
CID 7146658
(2,6-difluorophenyl)-(3-methoxyphenyl)methanol
CID 63893352
(R)-(4-chlorophenyl)-(3-methoxyphenyl)methanol
CID 7146657
(3-methoxyphenyl)-(3-phenyltriazol-4-yl)methanol
CID 114684694
(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol
CID 66135157
(3-methoxyphenyl)-(2,4,5-trimethylphenyl)methanol
CID 64985249
(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
CID 61083356
(3-methoxyphenyl)-(1-propylimidazol-2-yl)methanol
CID 61317073
(1R)-1-(3-methoxyphenyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamine
CID 25264906

Frequently Asked Questions

What is the IUPAC name of (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol?
The IUPAC name of (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol (CID 97293101) is (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol.
What is the SMILES notation for (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol?
The canonical SMILES for (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol is COc1cccc([C@@H](O)c2cccn2C)c1.
What is the InChIKey of (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol?
The InChIKey is YBNQSZFGNRMCPW-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H15NO2/c1-14-8-4-7-12(14)13(15)10-5-3-6-11(9-10)16-2/h3-9,13,15H,1-2H3/t13-/m1/s1.
What are the key properties of (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol?
(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol has a molecular weight of 217.27 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol is sourced from PubChem (CID 97293101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).