N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine

C10H16N2OS — CID 43609962

IUPACN-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine
SMILESCc1nc(CNC2CCOCC2)cs1
InChIInChI=1S/C10H16N2OS/c1-8-12-10(7-14-8)6-11-9-2-4-13-5-3-9/h7,9,11H,2-6H2,1H3
InChIKeyDHKASUNNFVXIRS-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.72
Rot. Bonds3

About N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine

N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine (PubChem CID 43609962) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine.

Molecular Properties

Compound NameN-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine
PubChem CID43609962
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine
SMILESCc1nc(CNC2CCOCC2)cs1
InChIInChI=1S/C10H16N2OS/c1-8-12-10(7-14-8)6-11-9-2-4-13-5-3-9/h7,9,11H,2-6H2,1H3
InChIKeyDHKASUNNFVXIRS-UHFFFAOYSA-N
XLogP1.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxolan-3-amine
CID 63335816
N-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexanamine
CID 28780749
N,N-dimethyl-4-[(oxan-4-ylamino)methyl]-1,3-thiazol-2-amine
CID 115671381
1-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
CID 43215967
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,1-dioxothian-4-amine
CID 43615105
N-[[2-(oxan-4-yl)-1,3-thiazol-4-yl]methyl]cyclopropanamine
CID 62385749
[4-[4-[(2-methyl-1,3-thiazol-4-yl)methylamino]piperidin-1-yl]phenyl]-morpholin-4-ylmethanone
CID 118757978
N-[[2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-yl]methyl]cyclopropanamine
CID 55119707
1-(3-methylbut-2-enyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
CID 61282827
4-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine
CID 115757938
1-methyl-5-[(2-methyl-1,3-thiazol-4-yl)methylamino]piperidin-2-one
CID 64654695
1-(1,3-dioxan-4-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
CID 81101919

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine?
The IUPAC name of N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine (CID 43609962) is N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine.
What is the SMILES notation for N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine?
The canonical SMILES for N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine is Cc1nc(CNC2CCOCC2)cs1.
What is the InChIKey of N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine?
The InChIKey is DHKASUNNFVXIRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-12-10(7-14-8)6-11-9-2-4-13-5-3-9/h7,9,11H,2-6H2,1H3.
What are the key properties of N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine?
N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine has a molecular weight of 212.32 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxan-4-amine is sourced from PubChem (CID 43609962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).