4-benzhydryl-1,3-thiazol-5-amine

C16H14N2S — CID 107292918

IUPAC4-benzhydryl-1,3-thiazol-5-amine
SMILESNc1scnc1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14N2S/c17-16-15(18-11-19-16)14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,17H2
InChIKeyONCACJIRBJHZRK-UHFFFAOYSA-N
MW266.37 g/mol
LogP3.91
Rot. Bonds3

About 4-benzhydryl-1,3-thiazol-5-amine

4-benzhydryl-1,3-thiazol-5-amine (PubChem CID 107292918) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is 4-benzhydryl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-benzhydryl-1,3-thiazol-5-amine
PubChem CID107292918
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC Name4-benzhydryl-1,3-thiazol-5-amine
SMILESNc1scnc1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14N2S/c17-16-15(18-11-19-16)14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,17H2
InChIKeyONCACJIRBJHZRK-UHFFFAOYSA-N
XLogP3.91
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-benzhydryl-1,3-thiazole-5-carboxylic acid
CID 82225499
3-benzhydrylpyrazin-2-amine
CID 107293051
azane;benzhydrylbenzene
CID 70581647
lithium benzhydrylbenzene
CID 18381038
4-(4-phenylphenyl)-1,3-thiazol-5-amine
CID 62081863
4-pentan-3-yl-1,3-thiazol-5-amine
CID 62082207
2-benzhydryl-1,3-thiazol-4-amine
CID 2882470
2-benzhydrylpyridin-3-ol
CID 125491889
(S)-(4-methyl-1,3-thiazol-5-yl)-phenylmethanamine
CID 10130445
6-benzhydrylpyridin-3-amine
CID 11086507
benzhydrylbenzene hexatetrafluoroborate
CID 173334521
4-benzhydrylbenzene-1,2-diamine
CID 154281140

Frequently Asked Questions

What is the IUPAC name of 4-benzhydryl-1,3-thiazol-5-amine?
The IUPAC name of 4-benzhydryl-1,3-thiazol-5-amine (CID 107292918) is 4-benzhydryl-1,3-thiazol-5-amine.
What is the SMILES notation for 4-benzhydryl-1,3-thiazol-5-amine?
The canonical SMILES for 4-benzhydryl-1,3-thiazol-5-amine is Nc1scnc1C(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-benzhydryl-1,3-thiazol-5-amine?
The InChIKey is ONCACJIRBJHZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c17-16-15(18-11-19-16)14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,17H2.
What are the key properties of 4-benzhydryl-1,3-thiazol-5-amine?
4-benzhydryl-1,3-thiazol-5-amine has a molecular weight of 266.37 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzhydryl-1,3-thiazol-5-amine is sourced from PubChem (CID 107292918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).