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

C20H19ClN2OS — CID 108748145

IUPACN-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(-c2csc(-c3ccc(Cl)cc3)n2)cc1
InChIInChI=1S/C20H19ClN2OS/c1-2-3-4-19(24)22-17-11-7-14(8-12-17)18-13-25-20(23-18)15-5-9-16(21)10-6-15/h5-13H,2-4H2,1H3,(H,22,24)
InChIKeyCGALZQZJJNXPEY-UHFFFAOYSA-N
MW370.91 g/mol
LogP6.26
Rot. Bonds6

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

N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide (PubChem CID 108748145) has the molecular formula C20H19ClN2OS and a molecular weight of 370.91 g/mol. Its IUPAC name is N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide.

Molecular Properties

Compound NameN-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide
PubChem CID108748145
Molecular FormulaC20H19ClN2OS
Molecular Weight370.91 g/mol
Exact Mass370.09
IUPAC NameN-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(-c2csc(-c3ccc(Cl)cc3)n2)cc1
InChIInChI=1S/C20H19ClN2OS/c1-2-3-4-19(24)22-17-11-7-14(8-12-17)18-13-25-20(23-18)15-5-9-16(21)10-6-15/h5-13H,2-4H2,1H3,(H,22,24)
InChIKeyCGALZQZJJNXPEY-UHFFFAOYSA-N
XLogP6.26
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.91
LogP ≤ 56.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108748184
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]decanamide
CID 4302943
3-(2-chlorophenoxy)-N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]propanamide
CID 108811086
N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]-3,3-diphenylpropanamide
CID 108748251
1-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]-3-phenylurea
CID 108784173
1-(4-chlorophenyl)-3-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]urea
CID 108780501
N-[[4-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methyl]pentanamide
CID 108738364
1-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]-3-prop-2-enylthiourea
CID 108784177
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-phenylbutanamide
CID 2978695
N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]-2,3,4-trifluorobenzamide
CID 108748174
N-[4-[2-(3-chloroanilino)-1,3-thiazol-4-yl]phenyl]heptanamide
CID 3553749
N-[4-[2-[4-(dimethylamino)phenyl]-1,3-thiazol-4-yl]phenyl]propanamide
CID 9173882

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide?
The IUPAC name of N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide (CID 108748145) is N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide.
What is the SMILES notation for N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide?
The canonical SMILES for N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide is CCCCC(=O)Nc1ccc(-c2csc(-c3ccc(Cl)cc3)n2)cc1.
What is the InChIKey of N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide?
The InChIKey is CGALZQZJJNXPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2OS/c1-2-3-4-19(24)22-17-11-7-14(8-12-17)18-13-25-20(23-18)15-5-9-16(21)10-6-15/h5-13H,2-4H2,1H3,(H,22,24).
What are the key properties of N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide?
N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide has a molecular weight of 370.91 g/mol, XLogP of 6.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide is sourced from PubChem (CID 108748145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).