N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide

C12H20N4O — CID 104618888

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide
SMILESCc1[nH]nc(NC(=O)C2(C)CCCNC2)c1C
InChIInChI=1S/C12H20N4O/c1-8-9(2)15-16-10(8)14-11(17)12(3)5-4-6-13-7-12/h13H,4-7H2,1-3H3,(H2,14,15,16,17)
InChIKeyAVFRDYAWSGONNX-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.35
Rot. Bonds2

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide (PubChem CID 104618888) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide
PubChem CID104618888
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide
SMILESCc1[nH]nc(NC(=O)C2(C)CCCNC2)c1C
InChIInChI=1S/C12H20N4O/c1-8-9(2)15-16-10(8)14-11(17)12(3)5-4-6-13-7-12/h13H,4-7H2,1-3H3,(H2,14,15,16,17)
InChIKeyAVFRDYAWSGONNX-UHFFFAOYSA-N
XLogP1.35
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-ethylpyrrolidine-3-carboxamide
CID 113433636
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-propylpyrrolidine-3-carboxamide
CID 113433645
N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide
CID 104618838
3-methyl-N-(2-methyl-3-pyridinyl)piperidine-3-carboxamide
CID 79043969
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
3-methyl-N-(3-methyl-1,2-oxazol-5-yl)piperidine-3-carboxamide
CID 63132333
3-methylpiperidine-3-carbohydrazide
CID 63991806
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
N-(4-chloro-2-pyridinyl)-3-methylpiperidine-3-carboxamide
CID 113357176
(3S)-3-methyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 129369013
3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
CID 119944674
N-(2,5-dichloro-4-methylphenyl)-3-methylpiperidine-3-carboxamide
CID 104727176

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide (CID 104618888) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide is Cc1[nH]nc(NC(=O)C2(C)CCCNC2)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide?
The InChIKey is AVFRDYAWSGONNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8-9(2)15-16-10(8)14-11(17)12(3)5-4-6-13-7-12/h13H,4-7H2,1-3H3,(H2,14,15,16,17).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 1.35, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide is sourced from PubChem (CID 104618888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).