4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide

C11H13N5OS — CID 65353990

IUPAC4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)Nc2nc(C3CC3)cs2)n1
InChIInChI=1S/C11H13N5OS/c1-16-4-7(12)9(15-16)10(17)14-11-13-8(5-18-11)6-2-3-6/h4-6H,2-3,12H2,1H3,(H,13,14,17)
InChIKeyPMDGYNGMKCGRSC-UHFFFAOYSA-N
MW263.33 g/mol
LogP1.59
Rot. Bonds3

About 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide

4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide (PubChem CID 65353990) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide
PubChem CID65353990
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC Name4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)Nc2nc(C3CC3)cs2)n1
InChIInChI=1S/C11H13N5OS/c1-16-4-7(12)9(15-16)10(17)14-11-13-8(5-18-11)6-2-3-6/h4-6H,2-3,12H2,1H3,(H,13,14,17)
InChIKeyPMDGYNGMKCGRSC-UHFFFAOYSA-N
XLogP1.59
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119292978
1-tert-butyl-3-cyclopropyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide
CID 94237843
4-amino-N-(1,3-benzothiazol-2-yl)-1-methylpyrazole-3-carboxamide
CID 65355063
2-cyclopropyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide
CID 155941439
3,6-dichloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 32869142
3-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-fluorobenzamide
CID 61479305
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylbutanamide
CID 79805640
3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
CID 32863174
2-(3-amino-1,2,4-triazol-1-yl)-N-(4-cyclopropyl-1,3-thiazol-2-yl)acetamide
CID 54958511
3,5-dibromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
CID 107980376
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-ethoxybenzamide
CID 81395596

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide (CID 65353990) is 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide is Cn1cc(N)c(C(=O)Nc2nc(C3CC3)cs2)n1.
What is the InChIKey of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide?
The InChIKey is PMDGYNGMKCGRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c1-16-4-7(12)9(15-16)10(17)14-11-13-8(5-18-11)6-2-3-6/h4-6H,2-3,12H2,1H3,(H,13,14,17).
What are the key properties of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide?
4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide has a molecular weight of 263.33 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 65353990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).