3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine

C15H22N4O — CID 82171816

IUPAC3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine
SMILESCCN(CC)Cc1cc(N)n(-c2ccc(OC)cc2)n1
InChIInChI=1S/C15H22N4O/c1-4-18(5-2)11-12-10-15(16)19(17-12)13-6-8-14(20-3)9-7-13/h6-10H,4-5,11,16H2,1-3H3
InChIKeyYUVFXCLTGSFPSU-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.30
Rot. Bonds6

About 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine

3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine (PubChem CID 82171816) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine
PubChem CID82171816
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine
SMILESCCN(CC)Cc1cc(N)n(-c2ccc(OC)cc2)n1
InChIInChI=1S/C15H22N4O/c1-4-18(5-2)11-12-10-15(16)19(17-12)13-6-8-14(20-3)9-7-13/h6-10H,4-5,11,16H2,1-3H3
InChIKeyYUVFXCLTGSFPSU-UHFFFAOYSA-N
XLogP2.30
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-[(4-methoxyphenyl)methylamino]propyl]-1-phenylpyrazol-5-amine;hydrochloride
CID 71933914
1-(4-methoxyphenyl)-3-(3-methylphenyl)pyrazol-5-amine
CID 4052140
1-(4-methoxyphenyl)-5-methylsulfanylpyrazol-3-amine
CID 83872098
1-(4-chlorophenyl)-3-propylpyrazol-5-amine
CID 82083521
4-[(dipropylamino)methyl]-1-(4-methoxyphenyl)pyrazol-5-amine
CID 82171687
[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]methanamine
CID 82072095
1-(4-tert-butylphenyl)-3-propylpyrazol-5-amine
CID 82089365
3-(4-methoxyphenyl)-1-(4-methylsulfonylphenyl)pyrazol-5-amine
CID 91872028
3-butyl-1-(4-fluorophenyl)pyrazol-5-amine
CID 82082766
3-amino-1-(4-methoxyphenyl)pyrazole-5-carboxylic acid
CID 83864095
5-ethyl-1-(4-methoxyphenyl)pyrazol-4-amine
CID 66441037
[1-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanamine
CID 82071935

Frequently Asked Questions

What is the IUPAC name of 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine?
The IUPAC name of 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine (CID 82171816) is 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine.
What is the SMILES notation for 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine?
The canonical SMILES for 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine is CCN(CC)Cc1cc(N)n(-c2ccc(OC)cc2)n1.
What is the InChIKey of 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine?
The InChIKey is YUVFXCLTGSFPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-4-18(5-2)11-12-10-15(16)19(17-12)13-6-8-14(20-3)9-7-13/h6-10H,4-5,11,16H2,1-3H3.
What are the key properties of 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine?
3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine has a molecular weight of 274.37 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylaminomethyl)-1-(4-methoxyphenyl)pyrazol-5-amine is sourced from PubChem (CID 82171816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).