N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine

C15H17NS — CID 3080259

IUPACN,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine
SMILESCN(C)Cc1ccccc1Sc1ccccc1
InChIInChI=1S/C15H17NS/c1-16(2)12-13-8-6-7-11-15(13)17-14-9-4-3-5-10-14/h3-11H,12H2,1-2H3
InChIKeyFUIKDYGWMKMQNR-UHFFFAOYSA-N
MW243.38 g/mol
LogP3.90
Rot. Bonds4

About N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine

N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine (PubChem CID 3080259) has the molecular formula C15H17NS and a molecular weight of 243.38 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine
PubChem CID3080259
Molecular FormulaC15H17NS
Molecular Weight243.38 g/mol
Exact Mass243.11
IUPAC NameN,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine
SMILESCN(C)Cc1ccccc1Sc1ccccc1
InChIInChI=1S/C15H17NS/c1-16(2)12-13-8-6-7-11-15(13)17-14-9-4-3-5-10-14/h3-11H,12H2,1-2H3
InChIKeyFUIKDYGWMKMQNR-UHFFFAOYSA-N
XLogP3.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N,N-dimethyl(2-(3-(trifluoromethyl)phenylthio)phenyl)methanamine
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CID 16640939
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CID 24103136
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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine?
The IUPAC name of N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine (CID 3080259) is N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine is CN(C)Cc1ccccc1Sc1ccccc1.
What is the InChIKey of N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine?
The InChIKey is FUIKDYGWMKMQNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NS/c1-16(2)12-13-8-6-7-11-15(13)17-14-9-4-3-5-10-14/h3-11H,12H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine?
N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine has a molecular weight of 243.38 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-phenylsulfanylphenyl)methanamine is sourced from PubChem (CID 3080259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).