1-ethyl-3-naphthalen-1-ylpyrazol-4-amine

C15H15N3 — CID 83217142

IUPAC1-ethyl-3-naphthalen-1-ylpyrazol-4-amine
SMILESCCn1cc(N)c(-c2cccc3ccccc23)n1
InChIInChI=1S/C15H15N3/c1-2-18-10-14(16)15(17-18)13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,2,16H2,1H3
InChIKeyGJJWUDLEODKLQH-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.31
Rot. Bonds2

About 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine

1-ethyl-3-naphthalen-1-ylpyrazol-4-amine (PubChem CID 83217142) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-3-naphthalen-1-ylpyrazol-4-amine
PubChem CID83217142
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name1-ethyl-3-naphthalen-1-ylpyrazol-4-amine
SMILESCCn1cc(N)c(-c2cccc3ccccc23)n1
InChIInChI=1S/C15H15N3/c1-2-18-10-14(16)15(17-18)13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,2,16H2,1H3
InChIKeyGJJWUDLEODKLQH-UHFFFAOYSA-N
XLogP3.31
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine?
The IUPAC name of 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine (CID 83217142) is 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine is CCn1cc(N)c(-c2cccc3ccccc23)n1.
What is the InChIKey of 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine?
The InChIKey is GJJWUDLEODKLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-2-18-10-14(16)15(17-18)13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,2,16H2,1H3.
What are the key properties of 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine?
1-ethyl-3-naphthalen-1-ylpyrazol-4-amine has a molecular weight of 237.31 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-naphthalen-1-ylpyrazol-4-amine is sourced from PubChem (CID 83217142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).