N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide

C15H19N3O2 — CID 19290408

IUPACN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
SMILESCCn1ncc(CNC(=O)c2ccc(OC)cc2)c1C
InChIInChI=1S/C15H19N3O2/c1-4-18-11(2)13(10-17-18)9-16-15(19)12-5-7-14(20-3)8-6-12/h5-8,10H,4,9H2,1-3H3,(H,16,19)
InChIKeyPMDRSFLXPIEFAU-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.15
Rot. Bonds5

About N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide

N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide (PubChem CID 19290408) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
PubChem CID19290408
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
SMILESCCn1ncc(CNC(=O)c2ccc(OC)cc2)c1C
InChIInChI=1S/C15H19N3O2/c1-4-18-11(2)13(10-17-18)9-16-15(19)12-5-7-14(20-3)8-6-12/h5-8,10H,4,9H2,1-3H3,(H,16,19)
InChIKeyPMDRSFLXPIEFAU-UHFFFAOYSA-N
XLogP2.15
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 ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]benzamide
CID 19290546
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19508772
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
CID 19288632
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2,3-dimethoxybenzamide
CID 35762282
3-[(2,5-dimethylphenoxy)methyl]-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
CID 19290435
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19290540
4-chloro-1-ethyl-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]pyrazole-5-carboxamide
CID 19477226
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide
CID 19290534
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]furan-2-carboxamide
CID 19290411
2-(4-chlorobenzoyl)-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]benzamide
CID 19290508
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
CID 19290341
N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
CID 3289325

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide?
The IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide (CID 19290408) is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide.
What is the SMILES notation for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide?
The canonical SMILES for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide is CCn1ncc(CNC(=O)c2ccc(OC)cc2)c1C.
What is the InChIKey of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide?
The InChIKey is PMDRSFLXPIEFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-18-11(2)13(10-17-18)9-16-15(19)12-5-7-14(20-3)8-6-12/h5-8,10H,4,9H2,1-3H3,(H,16,19).
What are the key properties of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide?
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide has a molecular weight of 273.34 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide is sourced from PubChem (CID 19290408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).