1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine

C15H20N2OS — CID 61487340

IUPAC1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
SMILESCCCc1nc(COc2ccccc2C(C)N)cs1
InChIInChI=1S/C15H20N2OS/c1-3-6-15-17-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)16/h4-5,7-8,10-11H,3,6,9,16H2,1-2H3
InChIKeyHKVOPXDSNZHJKL-UHFFFAOYSA-N
MW276.40 g/mol
LogP3.69
Rot. Bonds6

About 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine

1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine (PubChem CID 61487340) has the molecular formula C15H20N2OS and a molecular weight of 276.40 g/mol. Its IUPAC name is 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
PubChem CID61487340
Molecular FormulaC15H20N2OS
Molecular Weight276.40 g/mol
Exact Mass276.13
IUPAC Name1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
SMILESCCCc1nc(COc2ccccc2C(C)N)cs1
InChIInChI=1S/C15H20N2OS/c1-3-6-15-17-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)16/h4-5,7-8,10-11H,3,6,9,16H2,1-2H3
InChIKeyHKVOPXDSNZHJKL-UHFFFAOYSA-N
XLogP3.69
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine with MolForge

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Related Compounds

1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 61487424
(1S)-1-[4-fluoro-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 78935756
(1R)-1-[4-methyl-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 63649933
(1R)-1-[5-chloro-2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine
CID 63366752
1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61484148
2-[(2-propyl-1,3-thiazol-4-yl)methoxy]benzoic acid
CID 43310246
N-[[4-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 62459083
(1R)-1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-5-methylphenyl]ethanamine
CID 55190625
1-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61487826
[6-methyl-3-[(2-propyl-1,3-thiazol-4-yl)methoxy]-2-pyridinyl]methanamine
CID 79150632
4-[(4-fluorophenoxy)methyl]-2-propyl-1,3-thiazole
CID 60773447
1-[2-[(5-propyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 61495555

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine?
The IUPAC name of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine (CID 61487340) is 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine?
The canonical SMILES for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine is CCCc1nc(COc2ccccc2C(C)N)cs1.
What is the InChIKey of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine?
The InChIKey is HKVOPXDSNZHJKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c1-3-6-15-17-12(10-19-15)9-18-14-8-5-4-7-13(14)11(2)16/h4-5,7-8,10-11H,3,6,9,16H2,1-2H3.
What are the key properties of 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine?
1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine has a molecular weight of 276.40 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 61487340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).