N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide

C20H24ClNO2 — CID 110446431

IUPACN-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)NC(C)(C)c2cccc(Cl)c2)cc1
InChIInChI=1S/C20H24ClNO2/c1-19(2,14-9-11-17(24-5)12-10-14)18(23)22-20(3,4)15-7-6-8-16(21)13-15/h6-13H,1-5H3,(H,22,23)
InChIKeyQHFAVOJYHYXCAV-UHFFFAOYSA-N
MW345.87 g/mol
LogP4.68
Rot. Bonds5

About N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide

N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 110446431) has the molecular formula C20H24ClNO2 and a molecular weight of 345.87 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID110446431
Molecular FormulaC20H24ClNO2
Molecular Weight345.87 g/mol
Exact Mass345.15
IUPAC NameN-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)NC(C)(C)c2cccc(Cl)c2)cc1
InChIInChI=1S/C20H24ClNO2/c1-19(2,14-9-11-17(24-5)12-10-14)18(23)22-20(3,4)15-7-6-8-16(21)13-15/h6-13H,1-5H3,(H,22,23)
InChIKeyQHFAVOJYHYXCAV-UHFFFAOYSA-N
XLogP4.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110446437
N-(1-hydroxy-2-methylpropan-2-yl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110466111
2-(3-chlorophenyl)-2-[[2-(4-methoxyphenyl)acetyl]amino]propanamide
CID 71862052
N-[2-(3-chlorophenyl)propan-2-yl]-4-(trifluoromethyl)benzamide
CID 110445853
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763
N-(3-chloro-2-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438772
1-(4-chlorophenyl)-3-[2-(3-chlorophenyl)propan-2-yl]urea
CID 110446838
2-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)propan-2-yl]acetamide
CID 113091682
1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)propan-2-yl]urea
CID 113216421
2-(3-chlorophenyl)-2-methylpropanoic acid
CID 15582644
2-(3-chlorophenyl)-N-(2-hydroxyethyl)-2-methylpropanamide
CID 110437674
2-(4-methoxyphenyl)-2-methyl-N-pyrimidin-2-ylpropanamide
CID 110439569

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide (CID 110446431) is N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(C)(C)C(=O)NC(C)(C)c2cccc(Cl)c2)cc1.
What is the InChIKey of N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is QHFAVOJYHYXCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClNO2/c1-19(2,14-9-11-17(24-5)12-10-14)18(23)22-20(3,4)15-7-6-8-16(21)13-15/h6-13H,1-5H3,(H,22,23).
What are the key properties of N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide?
N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 345.87 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)propan-2-yl]-2-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 110446431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).