N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide

C22H26N2O3 — CID 55901466

IUPACN-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide
SMILESCCCOc1cc(C)ccc1NC(=O)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C22H26N2O3/c1-3-14-27-20-15-16(2)7-12-19(20)23-22(26)17-8-10-18(11-9-17)24-13-5-4-6-21(24)25/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,26)
InChIKeyUZFNVQJUXAFCMP-UHFFFAOYSA-N
MW366.46 g/mol
LogP4.55
Rot. Bonds6

About N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide

N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide (PubChem CID 55901466) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide
PubChem CID55901466
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide
SMILESCCCOc1cc(C)ccc1NC(=O)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C22H26N2O3/c1-3-14-27-20-15-16(2)7-12-19(20)23-22(26)17-8-10-18(11-9-17)24-13-5-4-6-21(24)25/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,26)
InChIKeyUZFNVQJUXAFCMP-UHFFFAOYSA-N
XLogP4.55
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36675659
N-(2-chloro-4-methylphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 7760528
N-[2-(4-methylphenoxy)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24681364
4-(2-oxopiperidin-1-yl)-N-[2-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 33372865
5-methoxy-N-(2-methoxyphenyl)-2-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]benzamide
CID 155513899
4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethoxy]-N-(4-methyl-2-propoxyphenyl)benzamide
CID 55901974
2,6-dichloro-N-(4-methyl-2-propoxyphenyl)pyridine-4-carboxamide
CID 87023490
N-(2-ethylphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 7750845
N-[2-(2-methoxyethoxy)-4-methylphenyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55892243
N-[2-oxo-2-(3-propoxyanilino)ethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 38824667
N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 17416795
N-methoxy-4-(2-oxopiperidin-1-yl)benzamide
CID 51279408

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide?
The IUPAC name of N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide (CID 55901466) is N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide.
What is the SMILES notation for N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide?
The canonical SMILES for N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide is CCCOc1cc(C)ccc1NC(=O)c1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide?
The InChIKey is UZFNVQJUXAFCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-3-14-27-20-15-16(2)7-12-19(20)23-22(26)17-8-10-18(11-9-17)24-13-5-4-6-21(24)25/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,26).
What are the key properties of N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide?
N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide has a molecular weight of 366.46 g/mol, XLogP of 4.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-propoxyphenyl)-4-(2-oxopiperidin-1-yl)benzamide is sourced from PubChem (CID 55901466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).