N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide

C22H25N3O2 — CID 71447785

IUPACN-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide
SMILESCOc1ccccc1CNC(=O)C(C)(C)n1cc(-c2ccccc2C)cn1
InChIInChI=1S/C22H25N3O2/c1-16-9-5-7-11-19(16)18-14-24-25(15-18)22(2,3)21(26)23-13-17-10-6-8-12-20(17)27-4/h5-12,14-15H,13H2,1-4H3,(H,23,26)
InChIKeyRBLBDJLDAPDIJF-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.92
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide

N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide (PubChem CID 71447785) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide
PubChem CID71447785
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide
SMILESCOc1ccccc1CNC(=O)C(C)(C)n1cc(-c2ccccc2C)cn1
InChIInChI=1S/C22H25N3O2/c1-16-9-5-7-11-19(16)18-14-24-25(15-18)22(2,3)21(26)23-13-17-10-6-8-12-20(17)27-4/h5-12,14-15H,13H2,1-4H3,(H,23,26)
InChIKeyRBLBDJLDAPDIJF-UHFFFAOYSA-N
XLogP3.92
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(3,4-dimethoxyphenyl)pyrazol-1-yl]-N-[(2-methoxyphenyl)methyl]-2-methylpropanamide
CID 71448491
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62834293
4-(1-tert-butylpyrazol-4-yl)-N-[[2-(difluoromethoxy)phenyl]methyl]-5-methylpyridine-2-carboxamide
CID 171682631
N-(2-ethyl-6-methylphenyl)-N'-[(2-methoxyphenyl)methyl]-2,2-dimethylpropanediamide
CID 108962937
2-amino-2-cyclopropyl-N-[(2-methoxyphenyl)methyl]propanamide
CID 54925372
tert-butyl N-[(2-methoxyphenyl)methyl]carbamate;hydrochloride
CID 174676513
2-[(2-methoxyphenyl)methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 108996645
2-[4-(3,4-dimethoxyphenyl)pyrazol-1-yl]-N-(2-methoxyethyl)-2-methylpropanamide
CID 71728692
(Z)-4-[(2-methoxyphenyl)methylamino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 63266732
1-(2-hydroxy-3,3-dimethylbutyl)-3-[(2-methoxyphenyl)methyl]urea
CID 111119483
4-[4-(4-chlorophenyl)pyrazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 3610947
2-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methyl-3-phenylbutanamide
CID 122144681

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide (CID 71447785) is N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide is COc1ccccc1CNC(=O)C(C)(C)n1cc(-c2ccccc2C)cn1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide?
The InChIKey is RBLBDJLDAPDIJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-16-9-5-7-11-19(16)18-14-24-25(15-18)22(2,3)21(26)23-13-17-10-6-8-12-20(17)27-4/h5-12,14-15H,13H2,1-4H3,(H,23,26).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide?
N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide has a molecular weight of 363.46 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-methyl-2-[4-(2-methylphenyl)pyrazol-1-yl]propanamide is sourced from PubChem (CID 71447785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).