1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine

C12H14N2OS — CID 4212091

IUPAC1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccccc2OC)cs1
InChIInChI=1S/C12H14N2OS/c1-13-7-12-14-10(8-16-12)9-5-3-4-6-11(9)15-2/h3-6,8,13H,7H2,1-2H3
InChIKeyHVPILTVDSASRHW-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.54
Rot. Bonds4

About 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine

1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine (PubChem CID 4212091) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
PubChem CID4212091
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccccc2OC)cs1
InChIInChI=1S/C12H14N2OS/c1-13-7-12-14-10(8-16-12)9-5-3-4-6-11(9)15-2/h3-6,8,13H,7H2,1-2H3
InChIKeyHVPILTVDSASRHW-UHFFFAOYSA-N
XLogP2.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 4009901
N-methyl-1-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]methanamine
CID 62544163
2,6-dimethoxy-4-[2-(methylaminomethyl)-1,3-thiazol-4-yl]phenol
CID 67214469
1-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 3299476
N-[[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 62543860
2-(2-bromophenyl)-4-(2-methoxyphenyl)-1,3-thiazole
CID 79831089
4-(2-methoxyphenyl)-N-phenyl-1,3-thiazol-2-amine
CID 4806347
5-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]methyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole
CID 53331370
4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole
CID 35618487
N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 4003372
3-[2-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]ethoxy]aniline
CID 82163148
N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(methylamino)butanamide;hydrochloride
CID 119713306

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine (CID 4212091) is 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine is CNCc1nc(-c2ccccc2OC)cs1.
What is the InChIKey of 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The InChIKey is HVPILTVDSASRHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c1-13-7-12-14-10(8-16-12)9-5-3-4-6-11(9)15-2/h3-6,8,13H,7H2,1-2H3.
What are the key properties of 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine has a molecular weight of 234.32 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine is sourced from PubChem (CID 4212091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).