2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol

C19H25N3O3S — CID 166637833

IUPAC2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol
SMILESO=S(=O)(C1CC1)N1CCC(n2cc(-c3ccc(CCO)cc3)cn2)CC1
InChIInChI=1S/C19H25N3O3S/c23-12-9-15-1-3-16(4-2-15)17-13-20-22(14-17)18-7-10-21(11-8-18)26(24,25)19-5-6-19/h1-4,13-14,18-19,23H,5-12H2
InChIKeyFFCWITHZGYCMJP-UHFFFAOYSA-N
MW375.49 g/mol
LogP2.21
Rot. Bonds6

About 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol

2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol (PubChem CID 166637833) has the molecular formula C19H25N3O3S and a molecular weight of 375.49 g/mol. Its IUPAC name is 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol
PubChem CID166637833
Molecular FormulaC19H25N3O3S
Molecular Weight375.49 g/mol
Exact Mass375.16
IUPAC Name2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol
SMILESO=S(=O)(C1CC1)N1CCC(n2cc(-c3ccc(CCO)cc3)cn2)CC1
InChIInChI=1S/C19H25N3O3S/c23-12-9-15-1-3-16(4-2-15)17-13-20-22(14-17)18-7-10-21(11-8-18)26(24,25)19-5-6-19/h1-4,13-14,18-19,23H,5-12H2
InChIKeyFFCWITHZGYCMJP-UHFFFAOYSA-N
XLogP2.21
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-[4-[4-(2-hydroxyethyl)phenyl]pyrazol-1-yl]piperidin-1-yl]ethanone
CID 166637826
2-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]ethanol
CID 166637809
4-[4-(4-bromophenyl)pyrazol-1-yl]-1-methylpiperidine
CID 170835984
[6-(1-cyclohexylpyrazol-4-yl)naphthalen-2-yl]methanol
CID 172868823
2-(1-piperidin-4-ylpyrazol-4-yl)ethanol
CID 105449212
2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol
CID 105449213
1-cyclopropyl-4-(4-propan-2-ylphenyl)pyrazole
CID 121383014
4-[1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrazol-4-yl]benzoic acid
CID 142325362
methyl 2-[3-(1-cyclopentylpyrazol-4-yl)-4-hydroxyphenyl]acetate
CID 171369408
3-[4-(4-iodophenyl)pyrazol-1-yl]thiolane 1,1-dioxide
CID 79784925
[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol
CID 79647766
6-fluoro-3-[1-[1-(trifluoromethylsulfonyl)piperidin-4-yl]pyrazol-4-yl]-1H-indole
CID 118060605

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol?
The IUPAC name of 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol (CID 166637833) is 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol.
What is the SMILES notation for 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol?
The canonical SMILES for 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol is O=S(=O)(C1CC1)N1CCC(n2cc(-c3ccc(CCO)cc3)cn2)CC1.
What is the InChIKey of 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol?
The InChIKey is FFCWITHZGYCMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3S/c23-12-9-15-1-3-16(4-2-15)17-13-20-22(14-17)18-7-10-21(11-8-18)26(24,25)19-5-6-19/h1-4,13-14,18-19,23H,5-12H2.
What are the key properties of 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol?
2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol has a molecular weight of 375.49 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(1-cyclopropylsulfonylpiperidin-4-yl)pyrazol-4-yl]phenyl]ethanol is sourced from PubChem (CID 166637833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).