2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

C15H20N4OS — CID 154845013

IUPAC2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCCC(C)n1nccc1C(=O)N(c1nc(C)cs1)C1CC1
InChIInChI=1S/C15H20N4OS/c1-4-11(3)19-13(7-8-16-19)14(20)18(12-5-6-12)15-17-10(2)9-21-15/h7-9,11-12H,4-6H2,1-3H3
InChIKeyYTBFUGBNKFUKCC-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.43
Rot. Bonds5

About 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (PubChem CID 154845013) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
PubChem CID154845013
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC Name2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCCC(C)n1nccc1C(=O)N(c1nc(C)cs1)C1CC1
InChIInChI=1S/C15H20N4OS/c1-4-11(3)19-13(7-8-16-19)14(20)18(12-5-6-12)15-17-10(2)9-21-15/h7-9,11-12H,4-6H2,1-3H3
InChIKeyYTBFUGBNKFUKCC-UHFFFAOYSA-N
XLogP3.43
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-(5-methylthiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 6464339
1-ethyl-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 649902
2-methyl-N-(1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 903234
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-1-ethyl-1H-pyrazole-5-carboxamide
CID 25854593
N-(5-methyl-1,3-thiazol-2-yl)-2-propylpyrazole-3-carboxamide
CID 35522280
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-propylpyrazole-3-carboxamide
CID 35532575
N-[4-(aminomethyl)-1,3-thiazol-2-yl]-1H-pyrazole-5-carboxamide
CID 56649133
1-Ethyl-N-(thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 891818
N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
CID 17144276
N-(4-(tert-butyl)thiazol-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
CID 42110937
N-(4-(tert-butyl)thiazol-2-yl)-1,4-dimethyl-1H-pyrazole-5-carboxamide
CID 45531101
1-(1-Ethyl-1H-pyrazole-3-carbonyl)-4-{4-[(4-methylpiperidin-1-YL)methyl]-1,3-thiazol-2-YL}piperazine
CID 53158710

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The IUPAC name of 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (CID 154845013) is 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is CCC(C)n1nccc1C(=O)N(c1nc(C)cs1)C1CC1.
What is the InChIKey of 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The InChIKey is YTBFUGBNKFUKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-4-11(3)19-13(7-8-16-19)14(20)18(12-5-6-12)15-17-10(2)9-21-15/h7-9,11-12H,4-6H2,1-3H3.
What are the key properties of 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 154845013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).