2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide

C13H19N5OS — CID 75396489

IUPAC2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide
SMILESCCCn1cc(NC(=O)c2sc(N(C)C)nc2C)cn1
InChIInChI=1S/C13H19N5OS/c1-5-6-18-8-10(7-14-18)16-12(19)11-9(2)15-13(20-11)17(3)4/h7-8H,5-6H2,1-4H3,(H,16,19)
InChIKeyDHPWVVOBKBCHTJ-UHFFFAOYSA-N
MW293.40 g/mol
LogP2.38
Rot. Bonds5

About 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide

2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide (PubChem CID 75396489) has the molecular formula C13H19N5OS and a molecular weight of 293.40 g/mol. Its IUPAC name is 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide
PubChem CID75396489
Molecular FormulaC13H19N5OS
Molecular Weight293.40 g/mol
Exact Mass293.13
IUPAC Name2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide
SMILESCCCn1cc(NC(=O)c2sc(N(C)C)nc2C)cn1
InChIInChI=1S/C13H19N5OS/c1-5-6-18-8-10(7-14-18)16-12(19)11-9(2)15-13(20-11)17(3)4/h7-8H,5-6H2,1-4H3,(H,16,19)
InChIKeyDHPWVVOBKBCHTJ-UHFFFAOYSA-N
XLogP2.38
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide (CID 75396489) is 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide is CCCn1cc(NC(=O)c2sc(N(C)C)nc2C)cn1.
What is the InChIKey of 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is DHPWVVOBKBCHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5OS/c1-5-6-18-8-10(7-14-18)16-12(19)11-9(2)15-13(20-11)17(3)4/h7-8H,5-6H2,1-4H3,(H,16,19).
What are the key properties of 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide?
2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 293.40 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-4-methyl-N-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 75396489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).