4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide

C15H27N5O — CID 66125626

IUPAC4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
SMILESCCn1nc(C)c(N)c1C(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C15H27N5O/c1-4-20-14(13(16)12(3)18-20)15(21)17-10-11(2)19-8-6-5-7-9-19/h11H,4-10,16H2,1-3H3,(H,17,21)
InChIKeyZAVYGPHZBABYNL-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.40
Rot. Bonds5

About 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide

4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide (PubChem CID 66125626) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
PubChem CID66125626
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
SMILESCCn1nc(C)c(N)c1C(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C15H27N5O/c1-4-20-14(13(16)12(3)18-20)15(21)17-10-11(2)19-8-6-5-7-9-19/h11H,4-10,16H2,1-3H3,(H,17,21)
InChIKeyZAVYGPHZBABYNL-UHFFFAOYSA-N
XLogP1.40
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-1-ethyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
CID 65357655
4-amino-1-ethyl-3-methyl-N-(2-methylsulfanylpropyl)pyrazole-5-carboxamide
CID 113466215
4-amino-1-ethyl-3-methyl-N-(3-methylsulfanylbutyl)pyrazole-5-carboxamide
CID 113493841
4-amino-N-cyclooctyl-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66125408
4-amino-1-ethyl-3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrazole-5-carboxamide
CID 66123485
4-amino-1-ethyl-N-hexyl-3-methylpyrazole-5-carboxamide
CID 66124652
4-amino-1-ethyl-N-(3-ethylpentan-2-yl)-3-methylpyrazole-5-carboxamide
CID 66125647
4-amino-N-cyclobutyl-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66124672
4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076238
4-amino-N-(1-cyclopropylpropan-2-yl)-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66123131
4-amino-1-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-3-methylpyrazole-5-carboxamide
CID 66125449
4-amino-1-ethyl-3-methyl-N-(thiolan-2-ylmethyl)pyrazole-5-carboxamide
CID 80585058

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide (CID 66125626) is 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide is CCn1nc(C)c(N)c1C(=O)NCC(C)N1CCCCC1.
What is the InChIKey of 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide?
The InChIKey is ZAVYGPHZBABYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-4-20-14(13(16)12(3)18-20)15(21)17-10-11(2)19-8-6-5-7-9-19/h11H,4-10,16H2,1-3H3,(H,17,21).
What are the key properties of 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide?
4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide has a molecular weight of 293.42 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide is sourced from PubChem (CID 66125626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).