1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol

C18H24N2O — CID 115419578

IUPAC1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCCn1nc(C)cc1CC1(O)CCC(C)c2ccccc21
InChIInChI=1S/C18H24N2O/c1-4-20-15(11-14(3)19-20)12-18(21)10-9-13(2)16-7-5-6-8-17(16)18/h5-8,11,13,21H,4,9-10,12H2,1-3H3
InChIKeyLHHAZJPPAUGYNM-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.54
Rot. Bonds3

About 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol

1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol (PubChem CID 115419578) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol.

Molecular Properties

Compound Name1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
PubChem CID115419578
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCCn1nc(C)cc1CC1(O)CCC(C)c2ccccc21
InChIInChI=1S/C18H24N2O/c1-4-20-15(11-14(3)19-20)12-18(21)10-9-13(2)16-7-5-6-8-17(16)18/h5-8,11,13,21H,4,9-10,12H2,1-3H3
InChIKeyLHHAZJPPAUGYNM-UHFFFAOYSA-N
XLogP3.54
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol with MolForge

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Related Compounds

4-methyl-1-[(1-methylpyrazol-3-yl)methyl]-3,4-dihydro-2H-naphthalen-1-ol
CID 82870214
1-(aminomethyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419502
1-[(2-fluorophenyl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419563
4-methyl-1-pentyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419566
1-[(2,5-dichlorophenyl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419671
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-3-methylcyclobutan-1-ol
CID 103564494
3-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-3-hydroxy-1H-indol-2-one
CID 83035129
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-2,4,4-trimethylcyclohexan-1-ol
CID 81315459
1-[(3-chloro-2-fluorophenyl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 102856985
3-amino-1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]cyclobutan-1-ol
CID 80561107
3-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-1,5-dimethylpyrrolidin-3-ol
CID 81468548
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-3,3,5,5-tetramethylcyclohexan-1-ol
CID 115999349

Frequently Asked Questions

What is the IUPAC name of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The IUPAC name of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol (CID 115419578) is 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol.
What is the SMILES notation for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The canonical SMILES for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol is CCn1nc(C)cc1CC1(O)CCC(C)c2ccccc21.
What is the InChIKey of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The InChIKey is LHHAZJPPAUGYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-20-15(11-14(3)19-20)12-18(21)10-9-13(2)16-7-5-6-8-17(16)18/h5-8,11,13,21H,4,9-10,12H2,1-3H3.
What are the key properties of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol?
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol has a molecular weight of 284.40 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol is sourced from PubChem (CID 115419578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).