2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine

C15H18N2S — CID 116888092

IUPAC2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCC(C)(N)c1csc(-c2ccc3c(c2)CCC3)n1
InChIInChI=1S/C15H18N2S/c1-15(2,16)13-9-18-14(17-13)12-7-6-10-4-3-5-11(10)8-12/h6-9H,3-5,16H2,1-2H3
InChIKeyCNOPOHGWZWEOPE-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.49
Rot. Bonds2

About 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine

2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine (PubChem CID 116888092) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine.

Molecular Properties

Compound Name2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine
PubChem CID116888092
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCC(C)(N)c1csc(-c2ccc3c(c2)CCC3)n1
InChIInChI=1S/C15H18N2S/c1-15(2,16)13-9-18-14(17-13)12-7-6-10-4-3-5-11(10)8-12/h6-9H,3-5,16H2,1-2H3
InChIKeyCNOPOHGWZWEOPE-UHFFFAOYSA-N
XLogP3.49
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-4-amine
CID 116864191
2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]ethanethiol
CID 116889549
3-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-1-ol
CID 116889140
2-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]propan-2-amine
CID 82515880
2-[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]propan-2-ol
CID 116890568
1-[2-(2,3-dihydro-1H-inden-5-yl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116884493
7-(4-amino-1,3-thiazol-2-yl)-3,4-dihydro-2H-naphthalen-1-one
CID 163359622
N-[(E)-1-(4-chlorophenyl)ethylideneamino]-2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-amine
CID 24882160
2-amino-2-methyl-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]propanamide
CID 119264633
2-[2-(5-bromothiophen-2-yl)-1,3-thiazol-4-yl]propan-2-amine
CID 116888095
2-[2-(3,4-dimethylphenyl)-1,3-thiazol-4-yl]propan-2-ol
CID 116890539
4-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1,3-thiazol-2-amine
CID 8878238

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine?
The IUPAC name of 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine (CID 116888092) is 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine.
What is the SMILES notation for 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine?
The canonical SMILES for 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine is CC(C)(N)c1csc(-c2ccc3c(c2)CCC3)n1.
What is the InChIKey of 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine?
The InChIKey is CNOPOHGWZWEOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c1-15(2,16)13-9-18-14(17-13)12-7-6-10-4-3-5-11(10)8-12/h6-9H,3-5,16H2,1-2H3.
What are the key properties of 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine?
2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine has a molecular weight of 258.39 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-4-yl]propan-2-amine is sourced from PubChem (CID 116888092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).