2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol

C19H19N7OS — CID 56644283

IUPAC2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol
SMILESCc1ccnc(Nc2nc(-c3cn[nH]c3-c3cncc(C(C)(C)O)c3)cs2)n1
InChIInChI=1S/C19H19N7OS/c1-11-4-5-21-17(23-11)25-18-24-15(10-28-18)14-9-22-26-16(14)12-6-13(8-20-7-12)19(2,3)27/h4-10,27H,1-3H3,(H,22,26)(H,21,23,24,25)
InChIKeyCNTVGIHPYWOYNP-UHFFFAOYSA-N
MW393.48 g/mol
LogP3.66
Rot. Bonds5

About 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol

2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol (PubChem CID 56644283) has the molecular formula C19H19N7OS and a molecular weight of 393.48 g/mol. Its IUPAC name is 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol.

Molecular Properties

Compound Name2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol
PubChem CID56644283
Molecular FormulaC19H19N7OS
Molecular Weight393.48 g/mol
Exact Mass393.14
IUPAC Name2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol
SMILESCc1ccnc(Nc2nc(-c3cn[nH]c3-c3cncc(C(C)(C)O)c3)cs2)n1
InChIInChI=1S/C19H19N7OS/c1-11-4-5-21-17(23-11)25-18-24-15(10-28-18)14-9-22-26-16(14)12-6-13(8-20-7-12)19(2,3)27/h4-10,27H,1-3H3,(H,22,26)(H,21,23,24,25)
InChIKeyCNTVGIHPYWOYNP-UHFFFAOYSA-N
XLogP3.66
TPSA112.50 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.48
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazole-5-carboxamide
CID 56644914
N-(4-methylpyrimidin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 71549400
4-(5-methyl-1H-pyrazol-4-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 42644808
4-[3-(2-methoxyethyl)-1-[(4-methoxyphenyl)methyl]pyrazol-4-yl]-N-(4-methylpyrimidin-2-yl)-1,3-thiazol-2-amine
CID 87402568
2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 90506101
N-methyl-4-(5-methyl-1H-pyrazol-4-yl)-1,3-thiazol-2-amine
CID 59363535
N-(4-methylpyrimidin-2-yl)-6H-pyrazolo[4,5-e][1,3]benzothiazol-2-amine
CID 56599804
N-(4-methylpyrimidin-2-yl)spiro[8-oxa-5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(10),2(6),3,12-tetraene-9,1'-cyclopropane]-4-amine
CID 163708602
4-(4-bromophenyl)-N-(4,6-dimethylpyrimidin-2-yl)-1,3-thiazol-2-amine
CID 1211245
4-[2-(pyrimidin-2-ylamino)-1,3-thiazol-4-yl]benzene-1,2-diol
CID 751856
N-(4-methylpyrimidin-2-yl)-5-propyl-5,6-dihydro-4H-pyrazolo[4,5-e][1,3]benzothiazol-2-amine
CID 56644071
4-[2-(2,4-dimethylphenoxy)phenyl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 166625295

Frequently Asked Questions

What is the IUPAC name of 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol?
The IUPAC name of 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol (CID 56644283) is 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol.
What is the SMILES notation for 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol?
The canonical SMILES for 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol is Cc1ccnc(Nc2nc(-c3cn[nH]c3-c3cncc(C(C)(C)O)c3)cs2)n1.
What is the InChIKey of 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol?
The InChIKey is CNTVGIHPYWOYNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7OS/c1-11-4-5-21-17(23-11)25-18-24-15(10-28-18)14-9-22-26-16(14)12-6-13(8-20-7-12)19(2,3)27/h4-10,27H,1-3H3,(H,22,26)(H,21,23,24,25).
What are the key properties of 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol?
2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol has a molecular weight of 393.48 g/mol, XLogP of 3.66, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[4-[2-[(4-methylpyrimidin-2-yl)amino]-1,3-thiazol-4-yl]-1H-pyrazol-5-yl]-3-pyridinyl]propan-2-ol is sourced from PubChem (CID 56644283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).