2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine

C15H16ClNS — CID 115841589

IUPAC2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
SMILESNC(Cc1ccc(Cl)s1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16ClNS/c16-15-7-6-13(18-15)9-14(17)12-5-4-10-2-1-3-11(10)8-12/h4-8,14H,1-3,9,17H2
InChIKeyYAKQVQGOLDSCRE-UHFFFAOYSA-N
MW277.82 g/mol
LogP4.13
Rot. Bonds3

About 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine

2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine (PubChem CID 115841589) has the molecular formula C15H16ClNS and a molecular weight of 277.82 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
PubChem CID115841589
Molecular FormulaC15H16ClNS
Molecular Weight277.82 g/mol
Exact Mass277.07
IUPAC Name2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
SMILESNC(Cc1ccc(Cl)s1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16ClNS/c16-15-7-6-13(18-15)9-14(17)12-5-4-10-2-1-3-11(10)8-12/h4-8,14H,1-3,9,17H2
InChIKeyYAKQVQGOLDSCRE-UHFFFAOYSA-N
XLogP4.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.82
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-2-(5-chlorothiophen-2-yl)ethanamine
CID 62607560
2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine
CID 62716425
2-(3-chloro-4-pyridinyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 112655443
2-(5-chlorothiophen-2-yl)-1-(4-ethylphenyl)ethanamine
CID 55095727
1-(2,3-dihydro-1H-inden-5-yl)-2-thiophen-3-ylethanamine
CID 61078821
1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine
CID 43115557
2-(5-chlorothiophen-2-yl)-1-(4-methoxyphenyl)ethanamine
CID 62608282
2-(4-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43152415
2-(4-bromophenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43109357
1-(2,3-dihydro-1H-inden-5-yl)-2-(oxan-4-yl)ethanamine
CID 115846820
2-(2-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43100360
2,3-dihydro-1H-inden-5-ylmethanediamine
CID 116939135

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine (CID 115841589) is 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine is NC(Cc1ccc(Cl)s1)c1ccc2c(c1)CCC2.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine?
The InChIKey is YAKQVQGOLDSCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNS/c16-15-7-6-13(18-15)9-14(17)12-5-4-10-2-1-3-11(10)8-12/h4-8,14H,1-3,9,17H2.
What are the key properties of 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine?
2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine has a molecular weight of 277.82 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine is sourced from PubChem (CID 115841589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).