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

C14H18N2S — CID 107853215

IUPACN-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2Cc3ccccc3C2)=N1
InChIInChI=1S/C14H18N2S/c1-2-12-9-17-14(15-12)16-13-7-10-5-3-4-6-11(10)8-13/h3-6,12-13H,2,7-9H2,1H3,(H,15,16)
InChIKeyIKRUPAVNOKOHCS-UHFFFAOYSA-N
MW246.38 g/mol
LogP2.62
Rot. Bonds2

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

N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 107853215) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID107853215
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2Cc3ccccc3C2)=N1
InChIInChI=1S/C14H18N2S/c1-2-12-9-17-14(15-12)16-13-7-10-5-3-4-6-11(10)8-13/h3-6,12-13H,2,7-9H2,1H3,(H,15,16)
InChIKeyIKRUPAVNOKOHCS-UHFFFAOYSA-N
XLogP2.62
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-inden-2-yl)-4,4a,5,6,7,7a-hexahydrocyclopenta[d][1,3]thiazin-2-amine
CID 106363861
4-benzyl-N-(4-ethylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63261659
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
4-ethyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43382066
4-benzyl-N-(1-methylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63261612
4-ethyl-N-(2-methyl-3-pyridinyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 79044170
N-(2,3-dihydro-1H-inden-2-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine
CID 107853220
N-(3-bromo-2-methylphenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 107637513
4-ethyl-N-(3-ethylpentan-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 65038636
4-ethyl-N-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439588
4-ethyl-N-(4-methylpiperazin-1-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 83017318

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 107853215) is N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is CCC1CSC(NC2Cc3ccccc3C2)=N1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is IKRUPAVNOKOHCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-2-12-9-17-14(15-12)16-13-7-10-5-3-4-6-11(10)8-13/h3-6,12-13H,2,7-9H2,1H3,(H,15,16).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 246.38 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 107853215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).