N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide

C23H26N4O2 — CID 25450557

IUPACN-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccnn1C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C23H26N4O2/c1-29-21-10-6-5-9-20(21)23(28)25-22-11-14-24-27(22)19-12-15-26(16-13-19)17-18-7-3-2-4-8-18/h2-11,14,19H,12-13,15-17H2,1H3,(H,25,28)
InChIKeyQVPAKCPDJIIUHL-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.98
Rot. Bonds6

About N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide

N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide (PubChem CID 25450557) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide
PubChem CID25450557
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccnn1C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C23H26N4O2/c1-29-21-10-6-5-9-20(21)23(28)25-22-11-14-24-27(22)19-12-15-26(16-13-19)17-18-7-3-2-4-8-18/h2-11,14,19H,12-13,15-17H2,1H3,(H,25,28)
InChIKeyQVPAKCPDJIIUHL-UHFFFAOYSA-N
XLogP3.98
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]pyrazol-3-yl]benzamide
CID 24793895
N-[2-[1-[(3-acetylphenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-methoxybenzamide
CID 25487941
2-methoxy-N-[2-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]benzamide
CID 25372817
2-methoxy-N-[2-(1-methylpiperidin-4-yl)pyrazol-3-yl]benzamide
CID 24817787
2-methoxy-N-[2-[1-(quinolin-5-ylmethyl)piperidin-4-yl]pyrazol-3-yl]benzamide
CID 29258956
N-[2-[1-(3-aminopropanoyl)piperidin-4-yl]pyrazol-3-yl]-2-methoxybenzamide
CID 56745952
N-[2-[1-[(2S)-1-amino-1-oxopropan-2-yl]piperidin-4-yl]pyrazol-3-yl]-2-methoxybenzamide
CID 95207495
N-[2-[1-[(2R)-4-(4-hydroxyphenyl)butan-2-yl]piperidin-4-yl]pyrazol-3-yl]-2-methoxybenzamide
CID 25452856
2-chloro-N-[2-[1-[(3-hydroxyphenyl)methyl]piperidin-4-yl]pyrazol-3-yl]benzamide
CID 42244340
N-[2-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]pyrazol-3-yl]benzamide
CID 42211407
N-[2-[1-[(2S)-2-amino-3-hydroxypropanoyl]piperidin-4-yl]pyrazol-3-yl]-2-methoxybenzamide;hydrochloride
CID 154885901
N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-3-fluorobenzamide
CID 42302028

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide?
The IUPAC name of N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide (CID 25450557) is N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide?
The canonical SMILES for N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccnn1C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide?
The InChIKey is QVPAKCPDJIIUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-29-21-10-6-5-9-20(21)23(28)25-22-11-14-24-27(22)19-12-15-26(16-13-19)17-18-7-3-2-4-8-18/h2-11,14,19H,12-13,15-17H2,1H3,(H,25,28).
What are the key properties of N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide?
N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide has a molecular weight of 390.49 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzylpiperidin-4-yl)pyrazol-3-yl]-2-methoxybenzamide is sourced from PubChem (CID 25450557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).