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

C10H18N2OS — CID 43610489

IUPAC4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2CCOCC2)=N1
InChIInChI=1S/C10H18N2OS/c1-2-8-7-14-10(11-8)12-9-3-5-13-6-4-9/h8-9H,2-7H2,1H3,(H,11,12)
InChIKeyBNLQGHMAFIUSPN-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.64
Rot. Bonds2

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

4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43610489) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43610489
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2CCOCC2)=N1
InChIInChI=1S/C10H18N2OS/c1-2-8-7-14-10(11-8)12-9-3-5-13-6-4-9/h8-9H,2-7H2,1H3,(H,11,12)
InChIKeyBNLQGHMAFIUSPN-UHFFFAOYSA-N
XLogP1.64
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439588
4-ethyl-N-(4-ethylcyclohexyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 113495991
4-benzyl-N-(4-ethylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63261659
4-ethyl-N-(3-ethylpentan-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 65038636
4-benzyl-N-cyclopropyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63261342
N-(2,6-dichlorophenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 65499811
2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]-N-propylpropanamide
CID 61477994
N-(oxolan-3-yl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 80713434
N-(oxan-4-yl)pyrimidin-2-amine;propane
CID 144986361
N-(1,1-dioxothian-3-yl)-4-ethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 113496081
(4R)-N-(4-butylphenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 2345416
4-ethyl-N-(2-methyl-3-pyridinyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 79044170

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 43610489) is 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is CCC1CSC(NC2CCOCC2)=N1.
What is the InChIKey of 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is BNLQGHMAFIUSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-2-8-7-14-10(11-8)12-9-3-5-13-6-4-9/h8-9H,2-7H2,1H3,(H,11,12).
What are the key properties of 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 214.33 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(oxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43610489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).