1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine

C15H23N3OS — CID 75376265

IUPAC1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
SMILESCc1ncsc1CN(C)C(C)c1ncc(C(C)(C)C)o1
InChIInChI=1S/C15H23N3OS/c1-10-12(20-9-17-10)8-18(6)11(2)14-16-7-13(19-14)15(3,4)5/h7,9,11H,8H2,1-6H3
InChIKeyVKIPMJJSRWORRC-UHFFFAOYSA-N
MW293.44 g/mol
LogP3.93
Rot. Bonds4

About 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine

1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine (PubChem CID 75376265) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
PubChem CID75376265
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC Name1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
SMILESCc1ncsc1CN(C)C(C)c1ncc(C(C)(C)C)o1
InChIInChI=1S/C15H23N3OS/c1-10-12(20-9-17-10)8-18(6)11(2)14-16-7-13(19-14)15(3,4)5/h7,9,11H,8H2,1-6H3
InChIKeyVKIPMJJSRWORRC-UHFFFAOYSA-N
XLogP3.93
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine with MolForge

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Related Compounds

1-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylethanamine
CID 71981103
3-[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]butanenitrile
CID 63821064
(2S)-1-ethylsulfanyl-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine
CID 97160188
2-methyl-3-[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]butanoic acid
CID 79413835
3-N,2-dimethyl-3-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-N-propan-2-ylbutane-1,3-diamine
CID 79408549
2-N-methyl-2-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-N-propan-2-ylbutane-1,2-diamine
CID 63837536
N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propane-2-sulfonamide
CID 63822516
5-tert-butyl-2-[(1R)-1-chloroethyl]-1,3-oxazole
CID 93105065
3-[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]butanehydrazide
CID 63840300
4,4-dimethoxy-2-N-methyl-2-N-[(4-methyl-1,3-thiazol-5-yl)methyl]butane-1,2-diamine
CID 66268814
1-(4-chlorophenyl)-2-[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]propan-1-one
CID 63838727
N',2,2-trimethyl-N'-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpropane-1,3-diamine
CID 63837706

Frequently Asked Questions

What is the IUPAC name of 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine?
The IUPAC name of 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine (CID 75376265) is 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine.
What is the SMILES notation for 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine?
The canonical SMILES for 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine is Cc1ncsc1CN(C)C(C)c1ncc(C(C)(C)C)o1.
What is the InChIKey of 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine?
The InChIKey is VKIPMJJSRWORRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-10-12(20-9-17-10)8-18(6)11(2)14-16-7-13(19-14)15(3,4)5/h7,9,11H,8H2,1-6H3.
What are the key properties of 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine?
1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine has a molecular weight of 293.44 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 75376265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).