[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine

C15H15N3OS — CID 23159284

IUPAC[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine
SMILESCc1oc(-c2ccccc2)nc1Cc1csc(CN)n1
InChIInChI=1S/C15H15N3OS/c1-10-13(7-12-9-20-14(8-16)17-12)18-15(19-10)11-5-3-2-4-6-11/h2-6,9H,7-8,16H2,1H3
InChIKeyJZSXWNGOUFUIAJ-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.16
Rot. Bonds4

About [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine

[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine (PubChem CID 23159284) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine
PubChem CID23159284
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine
SMILESCc1oc(-c2ccccc2)nc1Cc1csc(CN)n1
InChIInChI=1S/C15H15N3OS/c1-10-13(7-12-9-20-14(8-16)17-12)18-15(19-10)11-5-3-2-4-6-11/h2-6,9H,7-8,16H2,1H3
InChIKeyJZSXWNGOUFUIAJ-UHFFFAOYSA-N
XLogP3.16
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
CID 15616431
[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanamine
CID 46344053
(2-ethyl-1,3-thiazol-4-yl)methyl 5-methyl-2-phenyl-1,3-oxazole-4-carboxylate
CID 18165685
N'-hydroxy-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanimidamide
CID 57365509
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetaldehyde
CID 18984662
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide
CID 24675874
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]acetamide
CID 55663551
5-methyl-4-[(4-phenylphenyl)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole
CID 175236922
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 5-methylthiophene-2-carboxylate
CID 16611239
[4-[(4-phenylpyrazol-1-yl)methyl]-1,3-thiazol-2-yl]methanamine
CID 62769754
2-[2-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]sulfanyl-1,3-thiazol-4-yl]acetate
CID 86591673
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl N-tert-butylcarbamate
CID 174457972

Frequently Asked Questions

What is the IUPAC name of [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine?
The IUPAC name of [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine (CID 23159284) is [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine.
What is the SMILES notation for [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine?
The canonical SMILES for [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine is Cc1oc(-c2ccccc2)nc1Cc1csc(CN)n1.
What is the InChIKey of [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine?
The InChIKey is JZSXWNGOUFUIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-10-13(7-12-9-20-14(8-16)17-12)18-15(19-10)11-5-3-2-4-6-11/h2-6,9H,7-8,16H2,1H3.
What are the key properties of [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine?
[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine has a molecular weight of 285.37 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine is sourced from PubChem (CID 23159284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).