N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide

C11H15N5O — CID 43582691

IUPACN-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCc1cc(NC(=O)c2c(C)n[nH]c2C)n(C)n1
InChIInChI=1S/C11H15N5O/c1-6-5-9(16(4)15-6)12-11(17)10-7(2)13-14-8(10)3/h5H,1-4H3,(H,12,17)(H,13,14)
InChIKeyBQXLCHYWTDPJOU-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.32
Rot. Bonds2

About N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide

N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide (PubChem CID 43582691) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
PubChem CID43582691
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCc1cc(NC(=O)c2c(C)n[nH]c2C)n(C)n1
InChIInChI=1S/C11H15N5O/c1-6-5-9(16(4)15-6)12-11(17)10-7(2)13-14-8(10)3/h5H,1-4H3,(H,12,17)(H,13,14)
InChIKeyBQXLCHYWTDPJOU-UHFFFAOYSA-N
XLogP1.32
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide (CID 43582691) is N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide is Cc1cc(NC(=O)c2c(C)n[nH]c2C)n(C)n1.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The InChIKey is BQXLCHYWTDPJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-6-5-9(16(4)15-6)12-11(17)10-7(2)13-14-8(10)3/h5H,1-4H3,(H,12,17)(H,13,14).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide has a molecular weight of 233.27 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43582691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).