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

C7H14N2OS — CID 43148946

IUPACN-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCC(C)NC1=NCCS1
InChIInChI=1S/C7H14N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h6H,3-5H2,1-2H3,(H,8,9)
InChIKeyCZYRRGCQLJOCQM-UHFFFAOYSA-N
MW174.27 g/mol
LogP0.71
Rot. Bonds3

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

N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43148946) has the molecular formula C7H14N2OS and a molecular weight of 174.27 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43148946
Molecular FormulaC7H14N2OS
Molecular Weight174.27 g/mol
Exact Mass174.08
IUPAC NameN-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCC(C)NC1=NCCS1
InChIInChI=1S/C7H14N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h6H,3-5H2,1-2H3,(H,8,9)
InChIKeyCZYRRGCQLJOCQM-UHFFFAOYSA-N
XLogP0.71
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.27
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 63827565
N-[2-(2,2-difluoroethoxy)ethyl]-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 105916893
methyl N-(1-methoxypropan-2-yl)-N'-methylcarbamimidothioate
CID 123196613
N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068043
N-(2-methoxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43148926
N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43148945
N-(3-methoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43153356
N-(2-methoxyethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439563
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-(2-ethoxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43591357

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 43148946) is N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is COCC(C)NC1=NCCS1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is CZYRRGCQLJOCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h6H,3-5H2,1-2H3,(H,8,9).
What are the key properties of N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 174.27 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43148946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).