5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine

C15H15N3O2 — CID 3452215

IUPAC5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
SMILESCOc1cc(OC)c2ccccc2c1-c1cc(N)n[nH]1
InChIInChI=1S/C15H15N3O2/c1-19-12-8-13(20-2)15(11-7-14(16)18-17-11)10-6-4-3-5-9(10)12/h3-8H,1-2H3,(H3,16,17,18)
InChIKeySXRLFADRIWMWDO-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.83
Rot. Bonds3

About 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine

5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine (PubChem CID 3452215) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
PubChem CID3452215
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
SMILESCOc1cc(OC)c2ccccc2c1-c1cc(N)n[nH]1
InChIInChI=1S/C15H15N3O2/c1-19-12-8-13(20-2)15(11-7-14(16)18-17-11)10-6-4-3-5-9(10)12/h3-8H,1-2H3,(H3,16,17,18)
InChIKeySXRLFADRIWMWDO-UHFFFAOYSA-N
XLogP2.83
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-chloro-3,5,6-trimethoxyphenyl)-1H-pyrazol-3-amine
CID 117455938
5-(3-fluoro-2,5,6-trimethoxyphenyl)-1H-pyrazol-3-amine
CID 117421240
5-(3-chloro-2,5,6-trimethoxyphenyl)-1H-pyrazol-3-amine
CID 117455942
5-(2-bromo-3-methoxy-6-methylphenyl)-1H-pyrazol-3-amine
CID 117453081
5-(2-chloro-5,6-dimethoxy-3-propan-2-ylphenyl)-1H-pyrazol-3-amine
CID 117476497
5-(2-bromo-3,4-dimethoxy-6-methylphenyl)-1H-pyrazol-3-amine
CID 117496845
5-(2-chloro-3,4-dimethoxy-6-methylphenyl)-1H-pyrazol-3-amine
CID 117422703
5-(3-amino-1H-pyrazol-5-yl)-2-methoxyphenol
CID 130019057
5-(3-methoxynaphthalen-1-yl)-1H-pyrazol-3-amine
CID 118614697
5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
CID 3539207
2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5-methylphenol
CID 136993747
2-(3-amino-1H-pyrazol-5-yl)-3-methoxy-6-methylphenol
CID 136993746

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine (CID 3452215) is 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine is COc1cc(OC)c2ccccc2c1-c1cc(N)n[nH]1.
What is the InChIKey of 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
The InChIKey is SXRLFADRIWMWDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-19-12-8-13(20-2)15(11-7-14(16)18-17-11)10-6-4-3-5-9(10)12/h3-8H,1-2H3,(H3,16,17,18).
What are the key properties of 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine?
5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine has a molecular weight of 269.30 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethoxynaphthalen-1-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 3452215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).