4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine

C12H12N2OS — CID 154668725

IUPAC4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cccc(OC3CC3)c2)cs1
InChIInChI=1S/C12H12N2OS/c13-12-14-11(7-16-12)8-2-1-3-10(6-8)15-9-4-5-9/h1-3,6-7,9H,4-5H2,(H2,13,14)
InChIKeyHLGKRZCAYJSQCA-UHFFFAOYSA-N
MW232.31 g/mol
LogP2.93
Rot. Bonds3

About 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine

4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine (PubChem CID 154668725) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine
PubChem CID154668725
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cccc(OC3CC3)c2)cs1
InChIInChI=1S/C12H12N2OS/c13-12-14-11(7-16-12)8-2-1-3-10(6-8)15-9-4-5-9/h1-3,6-7,9H,4-5H2,(H2,13,14)
InChIKeyHLGKRZCAYJSQCA-UHFFFAOYSA-N
XLogP2.93
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(4-phenoxybutoxy)phenyl]-1,3-thiazol-2-amine
CID 28857485
4-[3-(oxolan-3-yloxymethyl)phenyl]-1,3-thiazol-2-amine
CID 155037577
4-[3-[4-(2-methylphenoxy)butoxy]phenyl]-1,3-thiazol-2-amine
CID 28857491
4-[6-(3-methoxyphenyl)-2-methyl-3-pyridinyl]-1,3-thiazol-2-amine
CID 82452981
4-chloro-6-(3-cyclopropyloxyphenyl)-2-propan-2-ylpyrimidine
CID 114523154
3-(2-amino-1,3-thiazol-4-yl)-N-cyclopropylbenzenesulfonamide
CID 39404850
3-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]aniline
CID 7148555
4-(3-anilinophenyl)-1,3-thiazol-2-amine
CID 155427302
ethane;4-phenyl-1,3-thiazol-2-amine
CID 91233366
2-[3-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-propylacetamide
CID 28857519
4-[2-[3-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-amine
CID 71463182
4-(4-cyclohexyl-3-methoxyphenyl)-1,3-thiazol-2-amine
CID 174492088

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine (CID 154668725) is 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine is Nc1nc(-c2cccc(OC3CC3)c2)cs1.
What is the InChIKey of 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is HLGKRZCAYJSQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c13-12-14-11(7-16-12)8-2-1-3-10(6-8)15-9-4-5-9/h1-3,6-7,9H,4-5H2,(H2,13,14).
What are the key properties of 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine?
4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 232.31 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopropyloxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 154668725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).