1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide

C13H23N5O — CID 66027903

IUPAC1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide
SMILESCc1nn(C(C)C)c(N2CCCC(C(N)=O)C2)c1N
InChIInChI=1S/C13H23N5O/c1-8(2)18-13(11(14)9(3)16-18)17-6-4-5-10(7-17)12(15)19/h8,10H,4-7,14H2,1-3H3,(H2,15,19)
InChIKeyUFXPDURKOPKNAN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.06
Rot. Bonds3

About 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide

1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide (PubChem CID 66027903) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide
PubChem CID66027903
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide
SMILESCc1nn(C(C)C)c(N2CCCC(C(N)=O)C2)c1N
InChIInChI=1S/C13H23N5O/c1-8(2)18-13(11(14)9(3)16-18)17-6-4-5-10(7-17)12(15)19/h8,10H,4-7,14H2,1-3H3,(H2,15,19)
InChIKeyUFXPDURKOPKNAN-UHFFFAOYSA-N
XLogP1.06
TPSA90.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide (CID 66027903) is 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide is Cc1nn(C(C)C)c(N2CCCC(C(N)=O)C2)c1N.
What is the InChIKey of 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide?
The InChIKey is UFXPDURKOPKNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-8(2)18-13(11(14)9(3)16-18)17-6-4-5-10(7-17)12(15)19/h8,10H,4-7,14H2,1-3H3,(H2,15,19).
What are the key properties of 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide?
1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide is sourced from PubChem (CID 66027903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).