N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide

C15H19N3O3 — CID 19329060

IUPACN-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cc(C)n(C)n2)c(OC)c1
InChIInChI=1S/C15H19N3O3/c1-10-7-11(17-18(10)2)9-16-15(19)13-6-5-12(20-3)8-14(13)21-4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyILEZAUQCUFIHAW-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.68
Rot. Bonds5

About N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide

N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide (PubChem CID 19329060) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide
PubChem CID19329060
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC NameN-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cc(C)n(C)n2)c(OC)c1
InChIInChI=1S/C15H19N3O3/c1-10-7-11(17-18(10)2)9-16-15(19)13-6-5-12(20-3)8-14(13)21-4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyILEZAUQCUFIHAW-UHFFFAOYSA-N
XLogP1.68
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide
CID 19294375
N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethylbenzamide
CID 19329057
2,4-dimethoxy-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 55735719
N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide
CID 19329054
2,4-dimethoxy-N-[[5-(4-phenylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16867492
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2,4-dimethoxybenzamide
CID 47861665
N-(2-hydroxyethyl)-2,4-dimethoxybenzamide
CID 43389009
N-[8-[(2,4-dimethoxybenzoyl)amino]octyl]-2,4-dimethoxybenzamide
CID 3517424
N-[6-[(2,4-dimethoxybenzoyl)amino]hexyl]-2,4-dimethoxybenzamide
CID 4051354
N-[(2,4-dimethoxyphenyl)methyl]-2,5-dimethylpyrazole-3-carboxamide
CID 87024506
N-[(3-hydroxyphenyl)methyl]-2,4-dimethoxybenzamide
CID 61018179
N-(furan-2-ylmethyl)-2,4-dimethoxybenzamide
CID 3118683

Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide?
The IUPAC name of N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide (CID 19329060) is N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide is COc1ccc(C(=O)NCc2cc(C)n(C)n2)c(OC)c1.
What is the InChIKey of N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide?
The InChIKey is ILEZAUQCUFIHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-10-7-11(17-18(10)2)9-16-15(19)13-6-5-12(20-3)8-14(13)21-4/h5-8H,9H2,1-4H3,(H,16,19).
What are the key properties of N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide?
N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide has a molecular weight of 289.34 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide is sourced from PubChem (CID 19329060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).