4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride

C14H10ClF2N3S — CID 23724361

IUPAC4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride
SMILESCl.Fc1ccc(-c2csc(Nc3ccccn3)n2)c(F)c1
InChIInChI=1S/C14H9F2N3S.ClH/c15-9-4-5-10(11(16)7-9)12-8-20-14(18-12)19-13-3-1-2-6-17-13;/h1-8H,(H,17,18,19);1H
InChIKeyDNLXDAPIMDRZFB-UHFFFAOYSA-N
MW325.77 g/mol
LogP4.65
Rot. Bonds3

About 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride

4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride (PubChem CID 23724361) has the molecular formula C14H10ClF2N3S and a molecular weight of 325.77 g/mol. Its IUPAC name is 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride
PubChem CID23724361
Molecular FormulaC14H10ClF2N3S
Molecular Weight325.77 g/mol
Exact Mass325.03
IUPAC Name4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride
SMILESCl.Fc1ccc(-c2csc(Nc3ccccn3)n2)c(F)c1
InChIInChI=1S/C14H9F2N3S.ClH/c15-9-4-5-10(11(16)7-9)12-8-20-14(18-12)19-13-3-1-2-6-17-13;/h1-8H,(H,17,18,19);1H
InChIKeyDNLXDAPIMDRZFB-UHFFFAOYSA-N
XLogP4.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.77
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride (CID 23724361) is 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride is Cl.Fc1ccc(-c2csc(Nc3ccccn3)n2)c(F)c1.
What is the InChIKey of 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is DNLXDAPIMDRZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N3S.ClH/c15-9-4-5-10(11(16)7-9)12-8-20-14(18-12)19-13-3-1-2-6-17-13;/h1-8H,(H,17,18,19);1H.
What are the key properties of 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride?
4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 325.77 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 23724361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).