4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide

C15H27N5O — CID 66123380

IUPAC4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCCc1nn(C)c(C(=O)NCCN2CCC(C)CC2)c1N
InChIInChI=1S/C15H27N5O/c1-4-12-13(16)14(19(3)18-12)15(21)17-7-10-20-8-5-11(2)6-9-20/h11H,4-10,16H2,1-3H3,(H,17,21)
InChIKeyVFZAOAMDCTXSHI-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.03
Rot. Bonds5

About 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide

4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide (PubChem CID 66123380) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide
PubChem CID66123380
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCCc1nn(C)c(C(=O)NCCN2CCC(C)CC2)c1N
InChIInChI=1S/C15H27N5O/c1-4-12-13(16)14(19(3)18-12)15(21)17-7-10-20-8-5-11(2)6-9-20/h11H,4-10,16H2,1-3H3,(H,17,21)
InChIKeyVFZAOAMDCTXSHI-UHFFFAOYSA-N
XLogP1.03
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 ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide?
The IUPAC name of 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide (CID 66123380) is 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide is CCc1nn(C)c(C(=O)NCCN2CCC(C)CC2)c1N.
What is the InChIKey of 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide?
The InChIKey is VFZAOAMDCTXSHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-4-12-13(16)14(19(3)18-12)15(21)17-7-10-20-8-5-11(2)6-9-20/h11H,4-10,16H2,1-3H3,(H,17,21).
What are the key properties of 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide?
4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide has a molecular weight of 293.42 g/mol, XLogP of 1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-ethyl-1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazole-5-carboxamide is sourced from PubChem (CID 66123380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).