N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride

C10H18Cl2N4O — CID 86775551

IUPACN-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride
SMILESCNC(=O)c1ccn(C2CCCNC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4O.2ClH/c1-11-10(15)9-4-6-14(13-9)8-3-2-5-12-7-8;;/h4,6,8,12H,2-3,5,7H2,1H3,(H,11,15);2*1H
InChIKeyDWCIQQHEAUOUEB-UHFFFAOYSA-N
MW281.19 g/mol
LogP1.01
Rot. Bonds2

About N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride

N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride (PubChem CID 86775551) has the molecular formula C10H18Cl2N4O and a molecular weight of 281.19 g/mol. Its IUPAC name is N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride
PubChem CID86775551
Molecular FormulaC10H18Cl2N4O
Molecular Weight281.19 g/mol
Exact Mass280.09
IUPAC NameN-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride
SMILESCNC(=O)c1ccn(C2CCCNC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4O.2ClH/c1-11-10(15)9-4-6-14(13-9)8-3-2-5-12-7-8;;/h4,6,8,12H,2-3,5,7H2,1H3,(H,11,15);2*1H
InChIKeyDWCIQQHEAUOUEB-UHFFFAOYSA-N
XLogP1.01
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride (CID 86775551) is N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride is CNC(=O)c1ccn(C2CCCNC2)n1.Cl.Cl.
What is the InChIKey of N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride?
The InChIKey is DWCIQQHEAUOUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O.2ClH/c1-11-10(15)9-4-6-14(13-9)8-3-2-5-12-7-8;;/h4,6,8,12H,2-3,5,7H2,1H3,(H,11,15);2*1H.
What are the key properties of N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride?
N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride has a molecular weight of 281.19 g/mol, XLogP of 1.01, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-piperidin-3-ylpyrazole-3-carboxamide;dihydrochloride is sourced from PubChem (CID 86775551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).