3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide

C10H14N6O — CID 104616226

IUPAC3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCCCc1cc(NC(=O)c2cc(N)n[nH]2)n[nH]1
InChIInChI=1S/C10H14N6O/c1-2-3-6-4-9(16-13-6)12-10(17)7-5-8(11)15-14-7/h4-5H,2-3H2,1H3,(H3,11,14,15)(H2,12,13,16,17)
InChIKeyRBEQFZLOIGGZQF-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.92
Rot. Bonds4

About 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide

3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide (PubChem CID 104616226) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide
PubChem CID104616226
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCCCc1cc(NC(=O)c2cc(N)n[nH]2)n[nH]1
InChIInChI=1S/C10H14N6O/c1-2-3-6-4-9(16-13-6)12-10(17)7-5-8(11)15-14-7/h4-5H,2-3H2,1H3,(H3,11,14,15)(H2,12,13,16,17)
InChIKeyRBEQFZLOIGGZQF-UHFFFAOYSA-N
XLogP0.92
TPSA112.48 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.92
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrrole-2-carboxamide
CID 104616213
4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
CID 104616173
3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-carboxamide
CID 104618246
4-(hydroxymethyl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 104619750
3-amino-2-ethoxy-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 104616145
2,4,6-trimethyl-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 115778074
N-(5-propyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-carboxamide
CID 115747889
2,4,6-trifluoro-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 115647444
3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propanoic acid
CID 104621777
4-propan-2-yl-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 115619793
5-amino-2,3-dichloro-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 107185838
2-amino-3-methoxy-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 104616207

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide (CID 104616226) is 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide is CCCc1cc(NC(=O)c2cc(N)n[nH]2)n[nH]1.
What is the InChIKey of 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is RBEQFZLOIGGZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-2-3-6-4-9(16-13-6)12-10(17)7-5-8(11)15-14-7/h4-5H,2-3H2,1H3,(H3,11,14,15)(H2,12,13,16,17).
What are the key properties of 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide?
3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 0.92, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 104616226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).