4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

C11H20N2OS — CID 83186709

IUPAC4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1CCSC(NC(C)C2CCCO2)=N1
InChIInChI=1S/C11H20N2OS/c1-8-5-7-15-11(12-8)13-9(2)10-4-3-6-14-10/h8-10H,3-7H2,1-2H3,(H,12,13)
InChIKeyDNSQRLXYRKUXQD-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.02
Rot. Bonds2

About 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 83186709) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID83186709
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1CCSC(NC(C)C2CCCO2)=N1
InChIInChI=1S/C11H20N2OS/c1-8-5-7-15-11(12-8)13-9(2)10-4-3-6-14-10/h8-10H,3-7H2,1-2H3,(H,12,13)
InChIKeyDNSQRLXYRKUXQD-UHFFFAOYSA-N
XLogP2.02
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3aR,5R,7aR)-5-ethyl-N-methyl-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]thiazol-2-imine
CID 137176925
(2-Butylimino-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]thiazol-5-yl)methanamine
CID 137247776
N-(oxolan-2-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 17338705
N-(oxolan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43148985
5-methyl-N-(oxolan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43440025
4-methyl-N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43534258
5-methyl-N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43534259
4-ethyl-N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43534262
N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43534263
N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43534264
4-(2-methylpropyl)-N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 61250765
N-(oxan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61611926

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 83186709) is 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is CC1CCSC(NC(C)C2CCCO2)=N1.
What is the InChIKey of 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is DNSQRLXYRKUXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-8-5-7-15-11(12-8)13-9(2)10-4-3-6-14-10/h8-10H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 228.36 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[1-(oxolan-2-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 83186709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).