N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide

C19H16N2OS — CID 35619010

IUPACN-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2csc(C3CC3)n2)cc1)c1ccccc1
InChIInChI=1S/C19H16N2OS/c22-18(14-4-2-1-3-5-14)20-16-10-8-13(9-11-16)17-12-23-19(21-17)15-6-7-15/h1-5,8-12,15H,6-7H2,(H,20,22)
InChIKeyVUDVHTVHFLWHPF-UHFFFAOYSA-N
MW320.42 g/mol
LogP4.94
Rot. Bonds4

About N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide

N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 35619010) has the molecular formula C19H16N2OS and a molecular weight of 320.42 g/mol. Its IUPAC name is N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID35619010
Molecular FormulaC19H16N2OS
Molecular Weight320.42 g/mol
Exact Mass320.10
IUPAC NameN-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2csc(C3CC3)n2)cc1)c1ccccc1
InChIInChI=1S/C19H16N2OS/c22-18(14-4-2-1-3-5-14)20-16-10-8-13(9-11-16)17-12-23-19(21-17)15-6-7-15/h1-5,8-12,15H,6-7H2,(H,20,22)
InChIKeyVUDVHTVHFLWHPF-UHFFFAOYSA-N
XLogP4.94
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-(2-cyclopropyl-1,3-thiazol-4-yl)benzamide
CID 53037722
4-(2-cyclopropyl-1,3-thiazol-4-yl)-N-(4-ethoxyphenyl)benzamide
CID 46394880
N-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 31263128
N-[[3-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl]methyl]benzamide
CID 53112573
4-acetamido-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2463728
N-[4-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]phenyl]benzamide
CID 110492822
4-acetamido-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167057
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
CID 40547504
N-(4-cyclopropylphenyl)-4-phenylbenzamide
CID 123874228
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
3-(2-cycloheptyl-1,3-thiazol-4-yl)benzoic acid
CID 65399902
[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-pyrrolidin-1-ylmethanone
CID 53037742

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide (CID 35619010) is N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide is O=C(Nc1ccc(-c2csc(C3CC3)n2)cc1)c1ccccc1.
What is the InChIKey of N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is VUDVHTVHFLWHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2OS/c22-18(14-4-2-1-3-5-14)20-16-10-8-13(9-11-16)17-12-23-19(21-17)15-6-7-15/h1-5,8-12,15H,6-7H2,(H,20,22).
What are the key properties of N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide?
N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 320.42 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 35619010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).