(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol

C15H20N2O2 — CID 103003603

IUPAC(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol
SMILESCc1cc([C@@H](C)O)ccc1OCCc1ccnn1C
InChIInChI=1S/C15H20N2O2/c1-11-10-13(12(2)18)4-5-15(11)19-9-7-14-6-8-16-17(14)3/h4-6,8,10,12,18H,7,9H2,1-3H3/t12-/m1/s1
InChIKeyILKVVCZCHBMHQL-GFCCVEGCSA-N
MW260.34 g/mol
LogP2.40
Rot. Bonds5

About (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol

(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol (PubChem CID 103003603) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol
PubChem CID103003603
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol
SMILESCc1cc([C@@H](C)O)ccc1OCCc1ccnn1C
InChIInChI=1S/C15H20N2O2/c1-11-10-13(12(2)18)4-5-15(11)19-9-7-14-6-8-16-17(14)3/h4-6,8,10,12,18H,7,9H2,1-3H3/t12-/m1/s1
InChIKeyILKVVCZCHBMHQL-GFCCVEGCSA-N
XLogP2.40
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[3-fluoro-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol
CID 103003611
1-[3-methyl-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 114528382
(1R)-1-[3-methyl-4-[2-(1-methylpyrazol-4-yl)ethoxy]phenyl]ethanol
CID 103003602
5-[2-(2,5-dimethylphenoxy)ethyl]-1-methylpyrazole
CID 103016135
(1S)-1-[5-bromo-2-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanamine
CID 102999821
1-[3-chloro-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]-N-methylethanamine
CID 102999983
5-[2-[2-(bromomethyl)-4-methylphenoxy]ethyl]-1-methylpyrazole
CID 103003791
1-[5-methyl-2-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanone
CID 103002738
4-methyl-3-[2-(2-methylpyrazol-3-yl)ethoxy]benzonitrile
CID 107663250
5-[2-(5-bromo-2-chlorophenoxy)ethyl]-1-methylpyrazole
CID 103002806
[5-fluoro-2-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]boronic acid
CID 103003887
1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol
CID 82090144

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol (CID 103003603) is (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol is Cc1cc([C@@H](C)O)ccc1OCCc1ccnn1C.
What is the InChIKey of (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol?
The InChIKey is ILKVVCZCHBMHQL-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-10-13(12(2)18)4-5-15(11)19-9-7-14-6-8-16-17(14)3/h4-6,8,10,12,18H,7,9H2,1-3H3/t12-/m1/s1.
What are the key properties of (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol?
(1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-methyl-4-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]ethanol is sourced from PubChem (CID 103003603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).