1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine

C19H15FN4OS — CID 1474421

IUPAC1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine
SMILESCOc1ccc(-c2cnn(-c3nc(-c4ccccc4F)cs3)c2N)cc1
InChIInChI=1S/C19H15FN4OS/c1-25-13-8-6-12(7-9-13)15-10-22-24(18(15)21)19-23-17(11-26-19)14-4-2-3-5-16(14)20/h2-11H,21H2,1H3
InChIKeyDUSVPEDWQZNECI-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.39
Rot. Bonds4

About 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine

1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine (PubChem CID 1474421) has the molecular formula C19H15FN4OS and a molecular weight of 366.42 g/mol. Its IUPAC name is 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine
PubChem CID1474421
Molecular FormulaC19H15FN4OS
Molecular Weight366.42 g/mol
Exact Mass366.10
IUPAC Name1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine
SMILESCOc1ccc(-c2cnn(-c3nc(-c4ccccc4F)cs3)c2N)cc1
InChIInChI=1S/C19H15FN4OS/c1-25-13-8-6-12(7-9-13)15-10-22-24(18(15)21)19-23-17(11-26-19)14-4-2-3-5-16(14)20/h2-11H,21H2,1H3
InChIKeyDUSVPEDWQZNECI-UHFFFAOYSA-N
XLogP4.39
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine?
The IUPAC name of 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine (CID 1474421) is 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine.
What is the SMILES notation for 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine?
The canonical SMILES for 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine is COc1ccc(-c2cnn(-c3nc(-c4ccccc4F)cs3)c2N)cc1.
What is the InChIKey of 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine?
The InChIKey is DUSVPEDWQZNECI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4OS/c1-25-13-8-6-12(7-9-13)15-10-22-24(18(15)21)19-23-17(11-26-19)14-4-2-3-5-16(14)20/h2-11H,21H2,1H3.
What are the key properties of 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine?
1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine has a molecular weight of 366.42 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)pyrazol-5-amine is sourced from PubChem (CID 1474421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).