N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide

C20H26N2O2 — CID 110446407

IUPACN-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccnc(C(C)(C)C)c2)cc1
InChIInChI=1S/C20H26N2O2/c1-19(2,3)17-13-15(11-12-21-17)22-18(23)20(4,5)14-7-9-16(24-6)10-8-14/h7-13H,1-6H3,(H,21,22,23)
InChIKeyQBQZAXJWRWPQFR-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.30
Rot. Bonds4

About N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide

N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 110446407) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID110446407
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccnc(C(C)(C)C)c2)cc1
InChIInChI=1S/C20H26N2O2/c1-19(2,3)17-13-15(11-12-21-17)22-18(23)20(4,5)14-7-9-16(24-6)10-8-14/h7-13H,1-6H3,(H,21,22,23)
InChIKeyQBQZAXJWRWPQFR-UHFFFAOYSA-N
XLogP4.30
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-2-methyl-N-(2-methyl-4-pyridinyl)propanamide
CID 110439571
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763
2-(4-methoxyphenyl)-2-methyl-N-pyrimidin-2-ylpropanamide
CID 110439569
N-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438804
N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 113197625
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438737
2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide
CID 113197444
N-(2-tert-butyl-4-pyridinyl)pyridine-4-carboxamide
CID 110444823
2-(4-methoxyphenyl)-2-methyl-N-(4-propan-2-ylphenyl)propanamide
CID 113197616
2-(3,5-dimethoxyphenyl)-N-[4-[[2-(3,5-dimethoxyphenyl)-2-methylpropanoyl]amino]phenyl]-2-methylpropanamide
CID 67082899
N-(2-tert-butyl-4-pyridinyl)-2-(4-chlorophenoxy)acetamide
CID 110442677
N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide
CID 110443287

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide (CID 110446407) is N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(C)(C)C(=O)Nc2ccnc(C(C)(C)C)c2)cc1.
What is the InChIKey of N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is QBQZAXJWRWPQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-19(2,3)17-13-15(11-12-21-17)22-18(23)20(4,5)14-7-9-16(24-6)10-8-14/h7-13H,1-6H3,(H,21,22,23).
What are the key properties of N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 326.44 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 110446407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).