N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide

C22H25N3O2 — CID 26292074

IUPACN-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide
SMILESCOCCN(Cc1ccccc1)C(=O)c1ccc(-n2nc(C)cc2C)cc1
InChIInChI=1S/C22H25N3O2/c1-17-15-18(2)25(23-17)21-11-9-20(10-12-21)22(26)24(13-14-27-3)16-19-7-5-4-6-8-19/h4-12,15H,13-14,16H2,1-3H3
InChIKeyFKFNBTBOELLYSO-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.78
Rot. Bonds7

About N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide

N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide (PubChem CID 26292074) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound NameN-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide
PubChem CID26292074
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC NameN-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide
SMILESCOCCN(Cc1ccccc1)C(=O)c1ccc(-n2nc(C)cc2C)cc1
InChIInChI=1S/C22H25N3O2/c1-17-15-18(2)25(23-17)21-11-9-20(10-12-21)22(26)24(13-14-27-3)16-19-7-5-4-6-8-19/h4-12,15H,13-14,16H2,1-3H3
InChIKeyFKFNBTBOELLYSO-UHFFFAOYSA-N
XLogP3.78
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-methylbenzamide
CID 26912749
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N,N-bis(2-methoxyethyl)benzamide
CID 56822003
benzyl 4-(3,5-dimethylpyrazol-1-yl)benzoate
CID 799986
4-(3,5-dimethylpyrazol-1-yl)-N-[(4-methoxyphenyl)methyl]-N-prop-2-enylbenzamide
CID 55918590
N-benzyl-N-(2-methoxyethyl)-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 27826735
4-(3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 55801026
N-benzyl-6-methoxy-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 134031302
N-benzyl-N-(2-methoxyethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 134028376
2-[[4-(3,5-dimethylpyrazol-1-yl)benzoyl]-methylamino]acetic acid
CID 119172398
N-benzyl-4-[(carbamoylamino)methyl]-N-(2-methoxyethyl)benzamide
CID 17419919
N-benzyl-N-(2-methoxyethyl)-2-phenyltriazole-4-carboxamide
CID 8891778
N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide
CID 38702132

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide?
The IUPAC name of N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide (CID 26292074) is N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide?
The canonical SMILES for N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide is COCCN(Cc1ccccc1)C(=O)c1ccc(-n2nc(C)cc2C)cc1.
What is the InChIKey of N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide?
The InChIKey is FKFNBTBOELLYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-17-15-18(2)25(23-17)21-11-9-20(10-12-21)22(26)24(13-14-27-3)16-19-7-5-4-6-8-19/h4-12,15H,13-14,16H2,1-3H3.
What are the key properties of N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide?
N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide has a molecular weight of 363.46 g/mol, XLogP of 3.78, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 26292074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).