5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine

C15H15N3O — CID 3539207

IUPAC5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
SMILESCCOc1ccc(-c2cc(N)n[nH]2)c2ccccc12
InChIInChI=1S/C15H15N3O/c1-2-19-14-8-7-11(13-9-15(16)18-17-13)10-5-3-4-6-12(10)14/h3-9H,2H2,1H3,(H3,16,17,18)
InChIKeySDCFJSYCAMMQSY-UHFFFAOYSA-N
MW253.31 g/mol
LogP3.21
Rot. Bonds3

About 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine

5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine (PubChem CID 3539207) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
PubChem CID3539207
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
SMILESCCOc1ccc(-c2cc(N)n[nH]2)c2ccccc12
InChIInChI=1S/C15H15N3O/c1-2-19-14-8-7-11(13-9-15(16)18-17-13)10-5-3-4-6-12(10)14/h3-9H,2H2,1H3,(H3,16,17,18)
InChIKeySDCFJSYCAMMQSY-UHFFFAOYSA-N
XLogP3.21
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(8-ethoxyquinolin-5-yl)-1H-pyrazol-3-amine
CID 117388997
5-(4-ethoxynaphthalen-1-yl)-4-iodo-1H-pyrazol-3-amine
CID 3294340
5-[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrazol-3-amine
CID 115533139
5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
CID 3480116
5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
CID 3452215
5-(3-ethyl-2-methoxyphenyl)-1H-pyrazol-3-amine
CID 117309562
N-[5-(3-amino-1H-pyrazol-5-yl)-2-ethoxyphenyl]acetamide
CID 82484529
3-[5-(2-ethoxyphenyl)-1H-pyrazol-3-yl]aniline
CID 54852298
5-[3-(1-fluoroethyl)-2-methoxyphenyl]-1H-pyrazol-3-amine
CID 117342094
5-(3-fluoro-2-methoxyphenyl)-1H-pyrazol-3-amine;hydrobromide
CID 117464714
5-(3-chloro-2-methoxy-4-methylphenyl)-1H-pyrazol-3-amine
CID 117348125
6-(2-aminophenyl)-2,3-diethoxyaniline
CID 175397921

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine (CID 3539207) is 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine is CCOc1ccc(-c2cc(N)n[nH]2)c2ccccc12.
What is the InChIKey of 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The InChIKey is SDCFJSYCAMMQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-2-19-14-8-7-11(13-9-15(16)18-17-13)10-5-3-4-6-12(10)14/h3-9H,2H2,1H3,(H3,16,17,18).
What are the key properties of 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine has a molecular weight of 253.31 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 3539207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).