N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide

C22H24N2OS — CID 108738364

IUPACN-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide
SMILESCCCCC(=O)NCc1ccc(-c2nc(-c3ccc(C)cc3)cs2)cc1
InChIInChI=1S/C22H24N2OS/c1-3-4-5-21(25)23-14-17-8-12-19(13-9-17)22-24-20(15-26-22)18-10-6-16(2)7-11-18/h6-13,15H,3-5,14H2,1-2H3,(H,23,25)
InChIKeyQEWIPZMQLOYSTD-UHFFFAOYSA-N
MW364.51 g/mol
LogP5.59
Rot. Bonds7

About N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide

N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide (PubChem CID 108738364) has the molecular formula C22H24N2OS and a molecular weight of 364.51 g/mol. Its IUPAC name is N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide.

Molecular Properties

Compound NameN-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide
PubChem CID108738364
Molecular FormulaC22H24N2OS
Molecular Weight364.51 g/mol
Exact Mass364.16
IUPAC NameN-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide
SMILESCCCCC(=O)NCc1ccc(-c2nc(-c3ccc(C)cc3)cs2)cc1
InChIInChI=1S/C22H24N2OS/c1-3-4-5-21(25)23-14-17-8-12-19(13-9-17)22-24-20(15-26-22)18-10-6-16(2)7-11-18/h6-13,15H,3-5,14H2,1-2H3,(H,23,25)
InChIKeyQEWIPZMQLOYSTD-UHFFFAOYSA-N
XLogP5.59
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.51
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]-3-phenylpropanamide
CID 108738477
2-methoxy-N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]acetamide
CID 108738461
1,1-diethyl-3-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]urea
CID 108738416
4-(4-methoxyphenyl)-N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]-4-oxobutanamide
CID 108738448
4-(2-methylphenoxy)-N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]butanamide
CID 108762394
phenyl N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]carbamate
CID 108738413
N-[(4-methylphenyl)methyl]heptanamide
CID 4159981
N-[(4-methylphenyl)methyl]hexadecanamide
CID 11111158
butyl N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]carbamate
CID 108739666
2-methoxy-N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]acetamide
CID 108739717
N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide
CID 108748145
4-fluoro-N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]benzamide
CID 108761184

Frequently Asked Questions

What is the IUPAC name of N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide?
The IUPAC name of N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide (CID 108738364) is N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide.
What is the SMILES notation for N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide?
The canonical SMILES for N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide is CCCCC(=O)NCc1ccc(-c2nc(-c3ccc(C)cc3)cs2)cc1.
What is the InChIKey of N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide?
The InChIKey is QEWIPZMQLOYSTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2OS/c1-3-4-5-21(25)23-14-17-8-12-19(13-9-17)22-24-20(15-26-22)18-10-6-16(2)7-11-18/h6-13,15H,3-5,14H2,1-2H3,(H,23,25).
What are the key properties of N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide?
N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide has a molecular weight of 364.51 g/mol, XLogP of 5.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide is sourced from PubChem (CID 108738364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).