1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine

C15H14N2OS — CID 64718148

IUPAC1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccco2)sc1-c1ccccc1
InChIInChI=1S/C15H14N2OS/c1-16-10-12-14(11-6-3-2-4-7-11)19-15(17-12)13-8-5-9-18-13/h2-9,16H,10H2,1H3
InChIKeyMQEMXRVZSXQFSB-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.79
Rot. Bonds4

About 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine

1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine (PubChem CID 64718148) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine
PubChem CID64718148
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccco2)sc1-c1ccccc1
InChIInChI=1S/C15H14N2OS/c1-16-10-12-14(11-6-3-2-4-7-11)19-15(17-12)13-8-5-9-18-13/h2-9,16H,10H2,1H3
InChIKeyMQEMXRVZSXQFSB-UHFFFAOYSA-N
XLogP3.79
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine (CID 64718148) is 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine is CNCc1nc(-c2ccco2)sc1-c1ccccc1.
What is the InChIKey of 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine?
The InChIKey is MQEMXRVZSXQFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-16-10-12-14(11-6-3-2-4-7-11)19-15(17-12)13-8-5-9-18-13/h2-9,16H,10H2,1H3.
What are the key properties of 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine?
1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine has a molecular weight of 270.36 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine is sourced from PubChem (CID 64718148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).