N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride

C11H20Cl2N4O — CID 119893048

IUPACN-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
SMILESCN(C(=O)C1CCCNC1)c1cnn(C)c1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-14-8-10(7-13-14)15(2)11(16)9-4-3-5-12-6-9;;/h7-9,12H,3-6H2,1-2H3;2*1H
InChIKeyOJCOJXFGEKOBKI-UHFFFAOYSA-N
MW295.21 g/mol
LogP1.23
Rot. Bonds2

About N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride

N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride (PubChem CID 119893048) has the molecular formula C11H20Cl2N4O and a molecular weight of 295.21 g/mol. Its IUPAC name is N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
PubChem CID119893048
Molecular FormulaC11H20Cl2N4O
Molecular Weight295.21 g/mol
Exact Mass294.10
IUPAC NameN-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
SMILESCN(C(=O)C1CCCNC1)c1cnn(C)c1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-14-8-10(7-13-14)15(2)11(16)9-4-3-5-12-6-9;;/h7-9,12H,3-6H2,1-2H3;2*1H
InChIKeyOJCOJXFGEKOBKI-UHFFFAOYSA-N
XLogP1.23
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 119893081
N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119300463
N-methyl-N-(1-methylpyrazol-4-yl)-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119893068
N-methyl-N-(1H-pyrrol-3-yl)piperidine-3-carboxamide
CID 115159892
N-(4-ethylphenyl)-N-methylpiperidine-3-carboxamide
CID 62002081
[4-(1-methylpyrazol-4-yl)piperazin-1-yl]-piperidin-3-ylmethanone;dihydrochloride
CID 119887289
N-(3,4-difluorophenyl)-N-methylpiperidine-3-carboxamide
CID 115159889
N-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 115159880
N-methyl-N-naphthalen-2-ylpiperidine-3-carboxamide
CID 115159907
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
N-(4-butylphenyl)-N-methylpiperidine-3-carboxamide
CID 119343628
(3R)-N-(3-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 81140173

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride (CID 119893048) is N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride is CN(C(=O)C1CCCNC1)c1cnn(C)c1.Cl.Cl.
What is the InChIKey of N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride?
The InChIKey is OJCOJXFGEKOBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.2ClH/c1-14-8-10(7-13-14)15(2)11(16)9-4-3-5-12-6-9;;/h7-9,12H,3-6H2,1-2H3;2*1H.
What are the key properties of N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride?
N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride has a molecular weight of 295.21 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119893048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).