4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide

C23H26N4O2 — CID 71839654

IUPAC4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide
SMILESCOc1cccc(-c2cc(C3CCN(C(=O)Nc4ccccc4C)CC3)[nH]n2)c1
InChIInChI=1S/C23H26N4O2/c1-16-6-3-4-9-20(16)24-23(28)27-12-10-17(11-13-27)21-15-22(26-25-21)18-7-5-8-19(14-18)29-2/h3-9,14-15,17H,10-13H2,1-2H3,(H,24,28)(H,25,26)
InChIKeyYHKOPDRDCYWKBW-UHFFFAOYSA-N
MW390.49 g/mol
LogP4.81
Rot. Bonds4

About 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide

4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide (PubChem CID 71839654) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide
PubChem CID71839654
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide
SMILESCOc1cccc(-c2cc(C3CCN(C(=O)Nc4ccccc4C)CC3)[nH]n2)c1
InChIInChI=1S/C23H26N4O2/c1-16-6-3-4-9-20(16)24-23(28)27-12-10-17(11-13-27)21-15-22(26-25-21)18-7-5-8-19(14-18)29-2/h3-9,14-15,17H,10-13H2,1-2H3,(H,24,28)(H,25,26)
InChIKeyYHKOPDRDCYWKBW-UHFFFAOYSA-N
XLogP4.81
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxy-2-methylphenyl)-4-[3-(3-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 71839667
N-(2,4-difluorophenyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 71839633
N-(4-chloro-2-fluorophenyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 71839622
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 71839636
N-(2,3-dimethylphenyl)-4-[6-(3-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide
CID 53103954
[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(1H-1,2,4-triazol-5-yl)piperidin-1-yl]methanone
CID 70749061
2-(3-methoxyphenyl)-N-(2-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 86264803
(4-aminopiperidin-1-yl)-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]methanone
CID 66485063
4-[4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]sulfonylbenzonitrile
CID 71839608
N-(2-fluorophenyl)-5-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]-1H-pyrazole-3-carboxamide
CID 91628916
N-(2-ethoxyphenyl)-4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide
CID 42761024
4-(4-methoxyphenyl)-N-(2-methylphenyl)piperazine-1-carboxamide
CID 6460818

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide (CID 71839654) is 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide is COc1cccc(-c2cc(C3CCN(C(=O)Nc4ccccc4C)CC3)[nH]n2)c1.
What is the InChIKey of 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide?
The InChIKey is YHKOPDRDCYWKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-16-6-3-4-9-20(16)24-23(28)27-12-10-17(11-13-27)21-15-22(26-25-21)18-7-5-8-19(14-18)29-2/h3-9,14-15,17H,10-13H2,1-2H3,(H,24,28)(H,25,26).
What are the key properties of 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide?
4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 4.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 71839654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).