2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol

C17H18N2O2 — CID 75522161

IUPAC2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol
SMILESOCCc1cnn(CCOc2cccc3ccccc23)c1
InChIInChI=1S/C17H18N2O2/c20-10-8-14-12-18-19(13-14)9-11-21-17-7-3-5-15-4-1-2-6-16(15)17/h1-7,12-13,20H,8-11H2
InChIKeyCHUKGNDPKKSHND-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.65
Rot. Bonds6

About 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol

2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol (PubChem CID 75522161) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol
PubChem CID75522161
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol
SMILESOCCc1cnn(CCOc2cccc3ccccc23)c1
InChIInChI=1S/C17H18N2O2/c20-10-8-14-12-18-19(13-14)9-11-21-17-7-3-5-15-4-1-2-6-16(15)17/h1-7,12-13,20H,8-11H2
InChIKeyCHUKGNDPKKSHND-UHFFFAOYSA-N
XLogP2.65
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethanol
CID 19242359
2-[2-amino-3-(2-naphthalen-1-yloxyethyl)benzimidazol-1-ium-1-yl]ethanol
CID 3614986
bis(2-naphthalen-1-yloxyethyl) carbonate
CID 57035339
benzene;naphthalen-1-yloxymethanol
CID 70447137
3-(2-naphthalen-1-yloxyethyl)triazole-4-carboxylic acid
CID 82209340
1-butoxynaphthalene;pentane-1,5-diol
CID 67747662
2-[1-[2-(2-chlorophenoxy)ethyl]triazol-4-yl]ethanol
CID 55066947
1-[2-(2-bromophenoxy)ethyl]-4-chloropyrazole
CID 169336743
1-(3-chloropropoxy)naphthalene
CID 12685615
2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol
CID 19242287
1-(2-naphthalen-1-yloxyethyl)-4-phenylmethoxyindole
CID 84571556
[1-(2-ethoxyethyl)pyrazol-4-yl]methanol
CID 62731815

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol?
The IUPAC name of 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol (CID 75522161) is 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol.
What is the SMILES notation for 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol?
The canonical SMILES for 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol is OCCc1cnn(CCOc2cccc3ccccc23)c1.
What is the InChIKey of 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol?
The InChIKey is CHUKGNDPKKSHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-10-8-14-12-18-19(13-14)9-11-21-17-7-3-5-15-4-1-2-6-16(15)17/h1-7,12-13,20H,8-11H2.
What are the key properties of 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol?
2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol has a molecular weight of 282.34 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-naphthalen-1-yloxyethyl)pyrazol-4-yl]ethanol is sourced from PubChem (CID 75522161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).