3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide

C15H19N3O2 — CID 35439410

IUPAC3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide
SMILESCOc1cccc(C(=O)Nc2ccnn2CC(C)C)c1
InChIInChI=1S/C15H19N3O2/c1-11(2)10-18-14(7-8-16-18)17-15(19)12-5-4-6-13(9-12)20-3/h4-9,11H,10H2,1-3H3,(H,17,19)
InChIKeyWUQRDBBSWNFZCY-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.80
Rot. Bonds5

About 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide

3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide (PubChem CID 35439410) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide
PubChem CID35439410
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide
SMILESCOc1cccc(C(=O)Nc2ccnn2CC(C)C)c1
InChIInChI=1S/C15H19N3O2/c1-11(2)10-18-14(7-8-16-18)17-15(19)12-5-4-6-13(9-12)20-3/h4-9,11H,10H2,1-3H3,(H,17,19)
InChIKeyWUQRDBBSWNFZCY-UHFFFAOYSA-N
XLogP2.80
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyano-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide
CID 35324088
4-fluoro-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide
CID 35327495
N-[2-(2-methylpropyl)pyrazol-3-yl]-3,4-dipropoxybenzamide
CID 134014296
3-chloro-5-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]-4-propoxybenzamide
CID 134014331
2-(2-methoxyphenoxy)-N-[2-(2-methylpropyl)pyrazol-3-yl]acetamide
CID 134026099
3-methoxy-N-(2-methyltriazol-4-yl)benzamide
CID 112535277
3-methoxy-N-[4-(2-methylpropylamino)phenyl]benzamide
CID 112980344
methyl 2-[3-[[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]carbamoyl]phenoxy]acetate
CID 55875529
N-[2-[(4-methoxyphenyl)methyl]pyrazol-3-yl]-4-(2-methylpropoxy)benzamide
CID 35579716
3-methoxy-N-[1-[(2S)-1-oxo-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl]piperidin-4-yl]benzamide
CID 51943124
N-(3-cyclopropyl-1-methylpyrazol-5-yl)-3-methoxybenzamide
CID 134797678
3-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide
CID 42958662

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide?
The IUPAC name of 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide (CID 35439410) is 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide is COc1cccc(C(=O)Nc2ccnn2CC(C)C)c1.
What is the InChIKey of 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide?
The InChIKey is WUQRDBBSWNFZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(2)10-18-14(7-8-16-18)17-15(19)12-5-4-6-13(9-12)20-3/h4-9,11H,10H2,1-3H3,(H,17,19).
What are the key properties of 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide?
3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide has a molecular weight of 273.34 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(2-methylpropyl)pyrazol-3-yl]benzamide is sourced from PubChem (CID 35439410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).