N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine

C15H10N4OS — CID 108777909

IUPACN-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine
SMILESc1ccc(-c2csc(Nc3nc4ccccc4o3)n2)nc1
InChIInChI=1S/C15H10N4OS/c1-2-7-13-11(6-1)17-14(20-13)19-15-18-12(9-21-15)10-5-3-4-8-16-10/h1-9H,(H,17,18,19)
InChIKeyIRIMIEAIJVPZQP-UHFFFAOYSA-N
MW294.34 g/mol
LogP4.09
Rot. Bonds3

About N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine

N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine (PubChem CID 108777909) has the molecular formula C15H10N4OS and a molecular weight of 294.34 g/mol. Its IUPAC name is N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine.

Molecular Properties

Compound NameN-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine
PubChem CID108777909
Molecular FormulaC15H10N4OS
Molecular Weight294.34 g/mol
Exact Mass294.06
IUPAC NameN-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine
SMILESc1ccc(-c2csc(Nc3nc4ccccc4o3)n2)nc1
InChIInChI=1S/C15H10N4OS/c1-2-7-13-11(6-1)17-14(20-13)19-15-18-12(9-21-15)10-5-3-4-8-16-10/h1-9H,(H,17,18,19)
InChIKeyIRIMIEAIJVPZQP-UHFFFAOYSA-N
XLogP4.09
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.34
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[4-[2-(1,3-benzoxazol-2-ylamino)-1,3-thiazol-4-yl]phenyl]methyl]acetamide
CID 108776305
N-(4-fluorophenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrobromide
CID 91800824
N-(4-methylpyrimidin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 71549400
N-(3,4-dimethylphenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 972690
N-(4-methoxyphenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride
CID 126477222
N-(6-methylpyrimidin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 108777905
4-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]benzoic acid
CID 704429
N-(4-morpholin-4-ylphenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 122192398
2-chloro-1-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzene-1,4-diamine
CID 82059224
N-(3-chloro-2-methylphenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 746698
2-[[4-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]phenyl]hydrazinylidene]propanedinitrile
CID 169339579
N-(5-iodo-4-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 86076382

Frequently Asked Questions

What is the IUPAC name of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine?
The IUPAC name of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine (CID 108777909) is N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine.
What is the SMILES notation for N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine?
The canonical SMILES for N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine is c1ccc(-c2csc(Nc3nc4ccccc4o3)n2)nc1.
What is the InChIKey of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine?
The InChIKey is IRIMIEAIJVPZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4OS/c1-2-7-13-11(6-1)17-14(20-13)19-15-18-12(9-21-15)10-5-3-4-8-16-10/h1-9H,(H,17,18,19).
What are the key properties of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine?
N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine has a molecular weight of 294.34 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzoxazol-2-amine is sourced from PubChem (CID 108777909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).