6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol

C16H16N2O2 — CID 167849922

IUPAC6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol
SMILESCOCc1c(-c2ccc3cc(O)ccc3c2)cnn1C
InChIInChI=1S/C16H16N2O2/c1-18-16(10-20-2)15(9-17-18)13-4-3-12-8-14(19)6-5-11(12)7-13/h3-9,19H,10H2,1-2H3
InChIKeyRLHNHWJNKZZXIJ-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.09
Rot. Bonds3

About 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol

6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol (PubChem CID 167849922) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol.

Molecular Properties

Compound Name6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol
PubChem CID167849922
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol
SMILESCOCc1c(-c2ccc3cc(O)ccc3c2)cnn1C
InChIInChI=1S/C16H16N2O2/c1-18-16(10-20-2)15(9-17-18)13-4-3-12-8-14(19)6-5-11(12)7-13/h3-9,19H,10H2,1-2H3
InChIKeyRLHNHWJNKZZXIJ-UHFFFAOYSA-N
XLogP3.09
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]-1H-pyridin-2-one
CID 155009662
2-[4-(4-hydroxyphenyl)-1-methylpyrazol-5-yl]acetic acid
CID 105423482
6-(4-hydroxy-2-methoxyphenyl)naphthalen-2-ol
CID 10125342
4-[5-(3-aminopropyl)-1-methylpyrazol-4-yl]phenol
CID 105423469
3-[5-(3-aminopropyl)-1-methylpyrazol-4-yl]phenol
CID 105423466
4-chloro-5-(methoxymethyl)-1-methylpyrazole
CID 19779911
[4-(4-chlorophenyl)-1-methylpyrazol-5-yl]methanol
CID 89482659
6-(2-methoxythiophen-3-yl)naphthalen-2-ol
CID 167854763
2-[4-(3-bromo-4-methoxyphenyl)-1-methylpyrazol-5-yl]acetic acid
CID 84606316
6-(2-hydroxyphenyl)naphthalen-2-ol
CID 11368353
(1-methyl-4-phenylpyrazol-5-yl)methanol
CID 83383743
3-(5-chloro-1-methylpyrazol-4-yl)phenol
CID 84676422

Frequently Asked Questions

What is the IUPAC name of 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol?
The IUPAC name of 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol (CID 167849922) is 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol.
What is the SMILES notation for 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol?
The canonical SMILES for 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol is COCc1c(-c2ccc3cc(O)ccc3c2)cnn1C.
What is the InChIKey of 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol?
The InChIKey is RLHNHWJNKZZXIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-18-16(10-20-2)15(9-17-18)13-4-3-12-8-14(19)6-5-11(12)7-13/h3-9,19H,10H2,1-2H3.
What are the key properties of 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol?
6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol has a molecular weight of 268.32 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(methoxymethyl)-1-methylpyrazol-4-yl]naphthalen-2-ol is sourced from PubChem (CID 167849922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).