2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine

C14H18N2OS — CID 82485697

IUPAC2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine
SMILESCc1nc(-c2ccc(OC(C)(C)C)cc2)c(N)s1
InChIInChI=1S/C14H18N2OS/c1-9-16-12(13(15)18-9)10-5-7-11(8-6-10)17-14(2,3)4/h5-8H,15H2,1-4H3
InChIKeyDLNIDSJOZSAQSM-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.88
Rot. Bonds2

About 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine

2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine (PubChem CID 82485697) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine
PubChem CID82485697
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine
SMILESCc1nc(-c2ccc(OC(C)(C)C)cc2)c(N)s1
InChIInChI=1S/C14H18N2OS/c1-9-16-12(13(15)18-9)10-5-7-11(8-6-10)17-14(2,3)4/h5-8H,15H2,1-4H3
InChIKeyDLNIDSJOZSAQSM-UHFFFAOYSA-N
XLogP3.88
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine
CID 62082548
2-cyclopropyl-4-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-5-amine
CID 62076679
2-bromo-4-(4-methylphenyl)-1,3-thiazol-5-amine
CID 84808579
2-methyl-5-[(2-methylpropan-2-yl)oxy]-1,3-benzothiazole
CID 89461022
4-(4-tert-butyl-2-methylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82484831
2-methyl-4-(3-propoxyphenyl)-1,3-thiazol-5-amine
CID 62498658
5-(5-amino-2-methyl-1,3-thiazol-4-yl)-2-methoxybenzonitrile
CID 65336309
4-(5-tert-butyl-2-methylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82484825
N-[5-amino-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2,2-dimethylpropanamide
CID 82342260
3-methyl-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]pyrazol-1-ide
CID 140648696
2-tert-butyl-4-(4-fluorophenyl)-1,3-thiazol-5-amine
CID 62076851
5-[4-[(2-methylpropan-2-yl)oxy]phenyl]thiophene-2-carbaldehyde
CID 82484736

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine?
The IUPAC name of 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine (CID 82485697) is 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine.
What is the SMILES notation for 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine?
The canonical SMILES for 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine is Cc1nc(-c2ccc(OC(C)(C)C)cc2)c(N)s1.
What is the InChIKey of 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine?
The InChIKey is DLNIDSJOZSAQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-9-16-12(13(15)18-9)10-5-7-11(8-6-10)17-14(2,3)4/h5-8H,15H2,1-4H3.
What are the key properties of 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine?
2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine has a molecular weight of 262.38 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3-thiazol-5-amine is sourced from PubChem (CID 82485697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).