N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide

C15H19N3O2 — CID 19454265

IUPACN-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
SMILESCCn1nccc1CN(C)C(=O)c1ccccc1OC
InChIInChI=1S/C15H19N3O2/c1-4-18-12(9-10-16-18)11-17(2)15(19)13-7-5-6-8-14(13)20-3/h5-10H,4,11H2,1-3H3
InChIKeyLRUFUNZKUSHGAM-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.18
Rot. Bonds5

About N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide

N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide (PubChem CID 19454265) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide.

Molecular Properties

Compound NameN-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
PubChem CID19454265
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
SMILESCCn1nccc1CN(C)C(=O)c1ccccc1OC
InChIInChI=1S/C15H19N3O2/c1-4-18-12(9-10-16-18)11-17(2)15(19)13-7-5-6-8-14(13)20-3/h5-10H,4,11H2,1-3H3
InChIKeyLRUFUNZKUSHGAM-UHFFFAOYSA-N
XLogP2.18
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 19454392
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]-N,3-dimethylpyrazole-4-carboxamide
CID 19477847
2-[(2-chlorophenoxy)methyl]-N-[(2-ethylpyrazol-3-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19478731
N-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 19451851
N-[(4-chloro-1-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 19450044
N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
CID 35520802
4-N-[(2-ethylpyrazol-3-yl)methyl]-4-N-methylbenzene-1,4-dicarboxamide
CID 122143622
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-2-phenylacetamide
CID 19454252
N-[(2-ethylpyrazol-3-yl)methyl]-N,1-dimethylpyrazole-3-carboxamide
CID 19278025
N-[(1-benzylpyrazol-4-yl)methyl]-2-methoxy-N-methylbenzamide
CID 31674674
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-4-phenylbutanamide
CID 35520918
N-[(2-ethylpyrazol-3-yl)methyl]-N,3,6-trimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 44821702

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide?
The IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide (CID 19454265) is N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide.
What is the SMILES notation for N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide?
The canonical SMILES for N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide is CCn1nccc1CN(C)C(=O)c1ccccc1OC.
What is the InChIKey of N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide?
The InChIKey is LRUFUNZKUSHGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-18-12(9-10-16-18)11-17(2)15(19)13-7-5-6-8-14(13)20-3/h5-10H,4,11H2,1-3H3.
What are the key properties of N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide?
N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide has a molecular weight of 273.34 g/mol, XLogP of 2.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide is sourced from PubChem (CID 19454265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).