2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine

C16H14ClNS — CID 62716425

IUPAC2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine
SMILESNC(Cc1ccc(Cl)s1)c1ccc2ccccc2c1
InChIInChI=1S/C16H14ClNS/c17-16-8-7-14(19-16)10-15(18)13-6-5-11-3-1-2-4-12(11)9-13/h1-9,15H,10,18H2
InChIKeyYRFIHLWVHDPYMB-UHFFFAOYSA-N
MW287.82 g/mol
LogP4.80
Rot. Bonds3

About 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine

2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine (PubChem CID 62716425) has the molecular formula C16H14ClNS and a molecular weight of 287.82 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine
PubChem CID62716425
Molecular FormulaC16H14ClNS
Molecular Weight287.82 g/mol
Exact Mass287.05
IUPAC Name2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine
SMILESNC(Cc1ccc(Cl)s1)c1ccc2ccccc2c1
InChIInChI=1S/C16H14ClNS/c17-16-8-7-14(19-16)10-15(18)13-6-5-11-3-1-2-4-12(11)9-13/h1-9,15H,10,18H2
InChIKeyYRFIHLWVHDPYMB-UHFFFAOYSA-N
XLogP4.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.82
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-ethylthiophen-2-yl)-1-naphthalen-2-ylethanamine
CID 62716426
1-(4-chlorophenyl)-2-(5-chlorothiophen-2-yl)ethanamine
CID 62607560
2-(5-chlorothiophen-2-yl)-1-(4-methoxyphenyl)ethanamine
CID 62608282
2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 115841589
2-(5-chlorothiophen-2-yl)-1-(4-ethylphenyl)ethanamine
CID 55095727
[1-(5-chlorothiophen-2-yl)-3-naphthalen-2-ylpropan-2-yl]hydrazine
CID 105295964
2-(5-methyl-1,3-thiazol-2-yl)-1-naphthalen-2-ylethanamine
CID 82066770
2-(5-chlorothiophen-2-yl)-1-(1H-pyrazol-4-yl)ethanamine
CID 130573212
2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine
CID 63416579
3-methyl-1-naphthalen-2-ylbutane-1,3-diamine
CID 116933649
2-(5-chlorothiophen-2-yl)-1-(2,5-dichlorophenyl)ethanamine
CID 115841631
(1S)-1-naphthalen-2-ylbutan-1-amine
CID 55254735

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine (CID 62716425) is 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine is NC(Cc1ccc(Cl)s1)c1ccc2ccccc2c1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine?
The InChIKey is YRFIHLWVHDPYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNS/c17-16-8-7-14(19-16)10-15(18)13-6-5-11-3-1-2-4-12(11)9-13/h1-9,15H,10,18H2.
What are the key properties of 2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine?
2-(5-chlorothiophen-2-yl)-1-naphthalen-2-ylethanamine has a molecular weight of 287.82 g/mol, XLogP of 4.80, 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-naphthalen-2-ylethanamine is sourced from PubChem (CID 62716425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).