2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide

C13H23N5O — CID 66128465

IUPAC2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
SMILESCCn1nc(C)cc1C(=O)NCCN1CCNCC1
InChIInChI=1S/C13H23N5O/c1-3-18-12(10-11(2)16-18)13(19)15-6-9-17-7-4-14-5-8-17/h10,14H,3-9H2,1-2H3,(H,15,19)
InChIKeyLRTULWRAEGAKKU-UHFFFAOYSA-N
MW265.36 g/mol
LogP-0.15
Rot. Bonds5

About 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide

2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide (PubChem CID 66128465) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
PubChem CID66128465
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
SMILESCCn1nc(C)cc1C(=O)NCCN1CCNCC1
InChIInChI=1S/C13H23N5O/c1-3-18-12(10-11(2)16-18)13(19)15-6-9-17-7-4-14-5-8-17/h10,14H,3-9H2,1-2H3,(H,15,19)
InChIKeyLRTULWRAEGAKKU-UHFFFAOYSA-N
XLogP-0.15
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
CID 66127121
2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide;hydrochloride
CID 119447776
2-ethyl-5-methyl-N-(2-piperidin-4-yloxyethyl)pyrazole-3-carboxamide
CID 66122627
1-[2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]ethyl]imidazole-4-carboxylic acid
CID 107496664
2-ethyl-N-(6-hydroxyhexyl)-5-methylpyrazole-3-carboxamide
CID 113351807
2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-sulfonamide
CID 122565353
6-methyl-N-(2-piperazin-1-ylethyl)pyridine-3-carboxamide
CID 43600318
N-(3-amino-3-hydroxyiminopropyl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 77113224
N-(4-aminopentyl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 114146447
N-(4-chloropentyl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 106129797
2-methyl-N-(2-piperazin-1-ylethyl)-5-sulfanylbenzamide
CID 107024052
4-bromo-N-(2-piperazin-1-ylethyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 43640202

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide?
The IUPAC name of 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide (CID 66128465) is 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide?
The canonical SMILES for 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide is CCn1nc(C)cc1C(=O)NCCN1CCNCC1.
What is the InChIKey of 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide?
The InChIKey is LRTULWRAEGAKKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-18-12(10-11(2)16-18)13(19)15-6-9-17-7-4-14-5-8-17/h10,14H,3-9H2,1-2H3,(H,15,19).
What are the key properties of 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide?
2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide has a molecular weight of 265.36 g/mol, XLogP of -0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 66128465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).