2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide

C14H17N3O3 — CID 104693736

IUPAC2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
SMILESCOc1ccc(O)c(C(=O)NCCc2ccnn2C)c1
InChIInChI=1S/C14H17N3O3/c1-17-10(6-8-16-17)5-7-15-14(19)12-9-11(20-2)3-4-13(12)18/h3-4,6,8-9,18H,5,7H2,1-2H3,(H,15,19)
InChIKeyKRQFXTSHNRUKCE-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.11
Rot. Bonds5

About 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide

2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide (PubChem CID 104693736) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
PubChem CID104693736
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
SMILESCOc1ccc(O)c(C(=O)NCCc2ccnn2C)c1
InChIInChI=1S/C14H17N3O3/c1-17-10(6-8-16-17)5-7-15-14(19)12-9-11(20-2)3-4-13(12)18/h3-4,6,8-9,18H,5,7H2,1-2H3,(H,15,19)
InChIKeyKRQFXTSHNRUKCE-UHFFFAOYSA-N
XLogP1.11
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dihydroxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 107723981
5-amino-2-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004068
2-hydroxy-5-methoxy-N-(3-pyrazol-1-ylpropyl)benzamide
CID 115579282
1-[(6-methoxynaphthalen-2-yl)methyl]-3-[2-(2-methylpyrazol-3-yl)ethyl]urea
CID 75478004
N-[2-(5-bromo-1-methylimidazol-4-yl)ethyl]-2-hydroxy-5-methoxybenzamide
CID 167838160
5-methoxy-2-[[2-(2-methylpyrazol-3-yl)ethylamino]methyl]phenol
CID 104694486
2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 104693761
2-hydroxy-N-(3-iodopropyl)-5-methoxybenzamide
CID 114504277
5-bromo-2-hydroxy-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 36886831
N-[2-(3-fluorophenyl)ethyl]-2-hydroxy-5-methoxybenzamide
CID 60666342
N-[2-(cyclopenten-1-yl)ethyl]-2-hydroxy-5-methoxybenzamide
CID 103842410
2-hydroxy-5-methoxy-N-[2-[methyl(propan-2-yl)amino]ethyl]benzamide
CID 62641545

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The IUPAC name of 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide (CID 104693736) is 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide.
What is the SMILES notation for 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The canonical SMILES for 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide is COc1ccc(O)c(C(=O)NCCc2ccnn2C)c1.
What is the InChIKey of 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The InChIKey is KRQFXTSHNRUKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-17-10(6-8-16-17)5-7-15-14(19)12-9-11(20-2)3-4-13(12)18/h3-4,6,8-9,18H,5,7H2,1-2H3,(H,15,19).
What are the key properties of 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide has a molecular weight of 275.31 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide is sourced from PubChem (CID 104693736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).