N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

C8H16N2OS — CID 64605504

IUPACN-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCCC(C)NC1=NCCS1
InChIInChI=1S/C8H16N2OS/c1-7(3-5-11-2)10-8-9-4-6-12-8/h7H,3-6H2,1-2H3,(H,9,10)
InChIKeyQYHWETZYCLSLDS-UHFFFAOYSA-N
MW188.30 g/mol
LogP1.10
Rot. Bonds4

About N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 64605504) has the molecular formula C8H16N2OS and a molecular weight of 188.30 g/mol. Its IUPAC name is N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID64605504
Molecular FormulaC8H16N2OS
Molecular Weight188.30 g/mol
Exact Mass188.10
IUPAC NameN-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCCC(C)NC1=NCCS1
InChIInChI=1S/C8H16N2OS/c1-7(3-5-11-2)10-8-9-4-6-12-8/h7H,3-6H2,1-2H3,(H,9,10)
InChIKeyQYHWETZYCLSLDS-UHFFFAOYSA-N
XLogP1.10
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethoxypropyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 135452621
4-(2-methoxyethyl)-N-[2-(trifluoromethylsulfanyl)ethyl]-1,3-thiazolidin-2-imine
CID 137010960
4-Methoxy-3,6-dimethyl-2-methylsulfanyl-1,4,5,6-tetrahydropyrimidin-3-ium
CID 4320189
N-(3-ethoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068309
N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43148946
N-(3-ethoxypropyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43148984
N-(3-methoxypropyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43153352
N-(3-methoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43153356
N-(1-methoxypropan-2-yl)-4-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439704
N-(1-methoxypropan-2-yl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439705
4-ethyl-N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43439708
N-(3-ethoxypropyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43440023

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 64605504) is N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is COCCC(C)NC1=NCCS1.
What is the InChIKey of N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is QYHWETZYCLSLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2OS/c1-7(3-5-11-2)10-8-9-4-6-12-8/h7H,3-6H2,1-2H3,(H,9,10).
What are the key properties of N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 188.30 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 64605504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).