5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide

C19H26N4O — CID 154737352

IUPAC5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]nc(C(C)C)c1C(=O)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H26N4O/c1-13(2)18-17(14(3)21-22-18)19(24)20-15-9-11-23(12-10-15)16-7-5-4-6-8-16/h4-8,13,15H,9-12H2,1-3H3,(H,20,24)(H,21,22)
InChIKeySZCHZTGIDIEZMP-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.24
Rot. Bonds4

About 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide

5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide (PubChem CID 154737352) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide
PubChem CID154737352
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]nc(C(C)C)c1C(=O)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H26N4O/c1-13(2)18-17(14(3)21-22-18)19(24)20-15-9-11-23(12-10-15)16-7-5-4-6-8-16/h4-8,13,15H,9-12H2,1-3H3,(H,20,24)(H,21,22)
InChIKeySZCHZTGIDIEZMP-UHFFFAOYSA-N
XLogP3.24
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-oxo-N-(1-phenylpiperidin-4-yl)-1H-pyridazine-3-carboxamide
CID 110745882
5-methyl-N-(1-phenylpyrrolidin-3-yl)-1H-pyrazole-3-carboxamide
CID 110484336
N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
CID 155657873
3-methyl-N-(1-phenylpiperidin-4-yl)benzamide
CID 110735842
3-amino-N-(1-phenylpiperidin-4-yl)butanamide;dihydrochloride
CID 119863025
1,5-dimethyl-N-(1-phenylpiperidin-4-yl)pyrazole-4-carboxamide
CID 86828696
5-chloro-N-[1-(4-ethylsulfonylphenyl)piperidin-4-yl]-3-methyl-1-phenylpyrazole-4-carboxamide
CID 60602914
4-methylsulfanyl-N-(1-phenylpiperidin-4-yl)benzamide
CID 86828685
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
3,5-dimethyl-N-(1-phenylpiperidin-4-yl)-1H-pyrazole-4-sulfonamide
CID 110735903
3-amino-5-methyl-N-(1-methylpiperidin-4-yl)-1H-pyrazole-4-carboxamide
CID 43373723
2-amino-2-(4-methylphenyl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120669904

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide (CID 154737352) is 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide is Cc1[nH]nc(C(C)C)c1C(=O)NC1CCN(c2ccccc2)CC1.
What is the InChIKey of 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide?
The InChIKey is SZCHZTGIDIEZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-13(2)18-17(14(3)21-22-18)19(24)20-15-9-11-23(12-10-15)16-7-5-4-6-8-16/h4-8,13,15H,9-12H2,1-3H3,(H,20,24)(H,21,22).
What are the key properties of 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide?
5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-phenylpiperidin-4-yl)-3-propan-2-yl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 154737352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).