5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine

C15H19N3OS — CID 120899230

IUPAC5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCC1CN(Cc2cnc(N)s2)CC(c2ccccc2)O1
InChIInChI=1S/C15H19N3OS/c1-11-8-18(9-13-7-17-15(16)20-13)10-14(19-11)12-5-3-2-4-6-12/h2-7,11,14H,8-10H2,1H3,(H2,16,17)
InChIKeyYTCIFHKASDAQCC-UHFFFAOYSA-N
MW289.40 g/mol
LogP2.69
Rot. Bonds3

About 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine

5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 120899230) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine
PubChem CID120899230
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCC1CN(Cc2cnc(N)s2)CC(c2ccccc2)O1
InChIInChI=1S/C15H19N3OS/c1-11-8-18(9-13-7-17-15(16)20-13)10-14(19-11)12-5-3-2-4-6-12/h2-7,11,14H,8-10H2,1H3,(H2,16,17)
InChIKeyYTCIFHKASDAQCC-UHFFFAOYSA-N
XLogP2.69
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine (CID 120899230) is 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine is CC1CN(Cc2cnc(N)s2)CC(c2ccccc2)O1.
What is the InChIKey of 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is YTCIFHKASDAQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-11-8-18(9-13-7-17-15(16)20-13)10-14(19-11)12-5-3-2-4-6-12/h2-7,11,14H,8-10H2,1H3,(H2,16,17).
What are the key properties of 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine?
5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 289.40 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methyl-6-phenylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 120899230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).