N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide

C19H24N4O — CID 42686470

IUPACN-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide
SMILESCc1[nH]nc(-c2ccc(N3CCCCC3)cc2)c1NC(=O)C1CC1
InChIInChI=1S/C19H24N4O/c1-13-17(20-19(24)15-5-6-15)18(22-21-13)14-7-9-16(10-8-14)23-11-3-2-4-12-23/h7-10,15H,2-6,11-12H2,1H3,(H,20,24)(H,21,22)
InChIKeyAVGZFYXOYZKFOD-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.72
Rot. Bonds4

About N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide

N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide (PubChem CID 42686470) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide
PubChem CID42686470
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide
SMILESCc1[nH]nc(-c2ccc(N3CCCCC3)cc2)c1NC(=O)C1CC1
InChIInChI=1S/C19H24N4O/c1-13-17(20-19(24)15-5-6-15)18(22-21-13)14-7-9-16(10-8-14)23-11-3-2-4-12-23/h7-10,15H,2-6,11-12H2,1H3,(H,20,24)(H,21,22)
InChIKeyAVGZFYXOYZKFOD-UHFFFAOYSA-N
XLogP3.72
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide (CID 42686470) is N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide is Cc1[nH]nc(-c2ccc(N3CCCCC3)cc2)c1NC(=O)C1CC1.
What is the InChIKey of N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide?
The InChIKey is AVGZFYXOYZKFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-13-17(20-19(24)15-5-6-15)18(22-21-13)14-7-9-16(10-8-14)23-11-3-2-4-12-23/h7-10,15H,2-6,11-12H2,1H3,(H,20,24)(H,21,22).
What are the key properties of N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide?
N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide has a molecular weight of 324.43 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-3-(4-piperidin-1-ylphenyl)-1H-pyrazol-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 42686470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).