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

C9H16N2OS — CID 43610492

IUPAC5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NC2CCOCC2)S1
InChIInChI=1S/C9H16N2OS/c1-7-6-10-9(13-7)11-8-2-4-12-5-3-8/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeySDGFTGHIWBIVJX-UHFFFAOYSA-N
MW200.31 g/mol
LogP1.25
Rot. Bonds1

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

5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43610492) has the molecular formula C9H16N2OS and a molecular weight of 200.31 g/mol. Its IUPAC name is 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43610492
Molecular FormulaC9H16N2OS
Molecular Weight200.31 g/mol
Exact Mass200.10
IUPAC Name5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NC2CCOCC2)S1
InChIInChI=1S/C9H16N2OS/c1-7-6-10-9(13-7)11-8-2-4-12-5-3-8/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeySDGFTGHIWBIVJX-UHFFFAOYSA-N
XLogP1.25
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 51.25
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
N-(3-ethoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068309
N-(3-ethoxypropyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43148984
N-(3-ethoxypropyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43440023
N-(3-methoxypropyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43440109
N-(oxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43610486
N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43610488
4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43610489
4-(2-methylpropyl)-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61251135
5-cyclopropyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296248
N-(oxan-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63363333
4-ethyl-N-(oxan-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63363334

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 43610492) is 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is CC1CN=C(NC2CCOCC2)S1.
What is the InChIKey of 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is SDGFTGHIWBIVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2OS/c1-7-6-10-9(13-7)11-8-2-4-12-5-3-8/h7-8H,2-6H2,1H3,(H,10,11).
What are the key properties of 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 200.31 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43610492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).