3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide

C9H12N6O2 — CID 114255287

IUPAC3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cc(NC(=O)c2cc(N)n[nH]2)nn1C
InChIInChI=1S/C9H12N6O2/c1-15-8(17-2)4-7(14-15)11-9(16)5-3-6(10)13-12-5/h3-4H,1-2H3,(H3,10,12,13)(H,11,14,16)
InChIKeyBWPFYWWRUYLSRO-UHFFFAOYSA-N
MW236.24 g/mol
LogP-0.01
Rot. Bonds3

About 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide

3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide (PubChem CID 114255287) has the molecular formula C9H12N6O2 and a molecular weight of 236.24 g/mol. Its IUPAC name is 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
PubChem CID114255287
Molecular FormulaC9H12N6O2
Molecular Weight236.24 g/mol
Exact Mass236.10
IUPAC Name3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cc(NC(=O)c2cc(N)n[nH]2)nn1C
InChIInChI=1S/C9H12N6O2/c1-15-8(17-2)4-7(14-15)11-9(16)5-3-6(10)13-12-5/h3-4H,1-2H3,(H3,10,12,13)(H,11,14,16)
InChIKeyBWPFYWWRUYLSRO-UHFFFAOYSA-N
XLogP-0.01
TPSA110.85 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 132298805
3-[chloro(difluoro)methoxy]-1-methyl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
CID 164879721
3-(2,2-difluoroethoxy)-1-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
CID 169141444
1-methyl-N-(5-methyl-1H-pyrazol-3-yl)-3-(2,2,2-trifluoroethoxy)pyrazole-5-carboxamide
CID 169142735
5-(difluoromethoxy)-1-methyl-N-(2,4,5-trimethylpyrazol-3-yl)pyrazole-3-carboxamide
CID 136531898
N-(5-methoxy-1-methylpyrazol-3-yl)-1-(2,2,2-trifluoroethyl)pyrazole-3-carboxamide
CID 138016990
N-(5-methoxy-1-methylpyrazol-3-yl)-4-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
CID 146142191
1-methyl-N-(1H-pyrazol-5-yl)-3-(trifluoromethoxy)pyrazole-5-carboxamide
CID 164879382
3-(2-fluoropropoxy)-1-methyl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
CID 169142125
[5-[[3-(hexanoylamino)-1H-pyrazole-5-carbonyl]amino]-1H-pyrazol-3-yl] N-butylcarbamate
CID 69689745
methyl [5-[(5-nitro-1H-pyrazole-3-carbonyl)amino]-1H-pyrazol-3-yl] carbonate
CID 136411949
3-methoxy-1-methyl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
CID 175923690

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide (CID 114255287) is 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide is COc1cc(NC(=O)c2cc(N)n[nH]2)nn1C.
What is the InChIKey of 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is BWPFYWWRUYLSRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6O2/c1-15-8(17-2)4-7(14-15)11-9(16)5-3-6(10)13-12-5/h3-4H,1-2H3,(H3,10,12,13)(H,11,14,16).
What are the key properties of 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 236.24 g/mol, XLogP of -0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 114255287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).