1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide

C11H19N5O — CID 43553957

IUPAC1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide
SMILESCc1nn(C)c(N2CCC(C(N)=O)CC2)c1N
InChIInChI=1S/C11H19N5O/c1-7-9(12)11(15(2)14-7)16-5-3-8(4-6-16)10(13)17/h8H,3-6,12H2,1-2H3,(H2,13,17)
InChIKeyVHRHWDBZPPNUHO-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.01
Rot. Bonds2

About 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide

1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide (PubChem CID 43553957) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide
PubChem CID43553957
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide
SMILESCc1nn(C)c(N2CCC(C(N)=O)CC2)c1N
InChIInChI=1S/C11H19N5O/c1-7-9(12)11(15(2)14-7)16-5-3-8(4-6-16)10(13)17/h8H,3-6,12H2,1-2H3,(H2,13,17)
InChIKeyVHRHWDBZPPNUHO-UHFFFAOYSA-N
XLogP0.01
TPSA90.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide (CID 43553957) is 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide is Cc1nn(C)c(N2CCC(C(N)=O)CC2)c1N.
What is the InChIKey of 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide?
The InChIKey is VHRHWDBZPPNUHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-7-9(12)11(15(2)14-7)16-5-3-8(4-6-16)10(13)17/h8H,3-6,12H2,1-2H3,(H2,13,17).
What are the key properties of 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide?
1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide has a molecular weight of 237.31 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-1,3-dimethylpyrazol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 43553957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).