5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine

C9H16N2OS — CID 62824538

IUPAC5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NCC2CCOC2)S1
InChIInChI=1S/C9H16N2OS/c1-7-4-10-9(13-7)11-5-8-2-3-12-6-8/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyFJRKHZONQJCJDT-UHFFFAOYSA-N
MW200.31 g/mol
LogP1.10
Rot. Bonds2

About 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine

5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 62824538) has the molecular formula C9H16N2OS and a molecular weight of 200.31 g/mol. Its IUPAC name is 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID62824538
Molecular FormulaC9H16N2OS
Molecular Weight200.31 g/mol
Exact Mass200.10
IUPAC Name5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NCC2CCOC2)S1
InChIInChI=1S/C9H16N2OS/c1-7-4-10-9(13-7)11-5-8-2-3-12-6-8/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyFJRKHZONQJCJDT-UHFFFAOYSA-N
XLogP1.10
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068309
N-(3-ethoxypropyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43440023
N-(4-methoxybutyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61814583
N-(4-methoxybutyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 61814792
N-[2-(3-methylbutoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 61881794
5-methyl-N-[2-(3-methylbutoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 61881992
N-(3-methoxy-2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61959502
N-(3-methoxy-2-methylpropyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 61959697
N-(oxolan-3-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 62824362
N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 62824363
5-cyclopropyl-N-(4-methoxybutyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296524
5-cyclopropyl-N-(3-ethoxypropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296603

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 62824538) is 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine is CC1CN=C(NCC2CCOC2)S1.
What is the InChIKey of 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is FJRKHZONQJCJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2OS/c1-7-4-10-9(13-7)11-5-8-2-3-12-6-8/h7-8H,2-6H2,1H3,(H,10,11).
What are the key properties of 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 200.31 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(oxolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 62824538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).