(2-phenylphenyl)-thiomorpholin-4-ylmethanone

C17H17NOS — CID 47227510

IUPAC(2-phenylphenyl)-thiomorpholin-4-ylmethanone
SMILESO=C(c1ccccc1-c1ccccc1)N1CCSCC1
InChIInChI=1S/C17H17NOS/c19-17(18-10-12-20-13-11-18)16-9-5-4-8-15(16)14-6-2-1-3-7-14/h1-9H,10-13H2
InChIKeyAMHWPAWBRRQURC-UHFFFAOYSA-N
MW283.40 g/mol
LogP3.54
Rot. Bonds2

About (2-phenylphenyl)-thiomorpholin-4-ylmethanone

(2-phenylphenyl)-thiomorpholin-4-ylmethanone (PubChem CID 47227510) has the molecular formula C17H17NOS and a molecular weight of 283.40 g/mol. Its IUPAC name is (2-phenylphenyl)-thiomorpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-phenylphenyl)-thiomorpholin-4-ylmethanone
PubChem CID47227510
Molecular FormulaC17H17NOS
Molecular Weight283.40 g/mol
Exact Mass283.10
IUPAC Name(2-phenylphenyl)-thiomorpholin-4-ylmethanone
SMILESO=C(c1ccccc1-c1ccccc1)N1CCSCC1
InChIInChI=1S/C17H17NOS/c19-17(18-10-12-20-13-11-18)16-9-5-4-8-15(16)14-6-2-1-3-7-14/h1-9H,10-13H2
InChIKeyAMHWPAWBRRQURC-UHFFFAOYSA-N
XLogP3.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(thiomorpholine-4-carbonyl)benzoic acid
CID 14298712
(2-chlorophenyl)-thiomorpholin-4-ylmethanone
CID 2804981
2-(1,4-thiazepane-4-carbonyl)benzoic acid
CID 61419510
[4-(1-hydroxyethyl)piperidin-1-yl]-(2-phenylphenyl)methanone
CID 111429801
5-[2-(thiomorpholine-4-carbonyl)phenyl]furan-2-carbaldehyde
CID 169333844
[4-(4-aminophenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
CID 17234149
(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone
CID 154351103
(2-pyrrolidin-1-ylphenyl)-thiomorpholin-4-ylmethanone
CID 168513754
[2-(4-fluorophenyl)phenyl]-pyrrolidin-1-ylmethanone
CID 134955966
(3-methylpiperidin-1-yl)-(2-phenylphenyl)methanone
CID 145074251
[4-[4-(furan-2-yl)phenyl]piperazin-1-yl]-(2-phenylphenyl)methanone
CID 168527219
[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
CID 2948850

Frequently Asked Questions

What is the IUPAC name of (2-phenylphenyl)-thiomorpholin-4-ylmethanone?
The IUPAC name of (2-phenylphenyl)-thiomorpholin-4-ylmethanone (CID 47227510) is (2-phenylphenyl)-thiomorpholin-4-ylmethanone.
What is the SMILES notation for (2-phenylphenyl)-thiomorpholin-4-ylmethanone?
The canonical SMILES for (2-phenylphenyl)-thiomorpholin-4-ylmethanone is O=C(c1ccccc1-c1ccccc1)N1CCSCC1.
What is the InChIKey of (2-phenylphenyl)-thiomorpholin-4-ylmethanone?
The InChIKey is AMHWPAWBRRQURC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NOS/c19-17(18-10-12-20-13-11-18)16-9-5-4-8-15(16)14-6-2-1-3-7-14/h1-9H,10-13H2.
What are the key properties of (2-phenylphenyl)-thiomorpholin-4-ylmethanone?
(2-phenylphenyl)-thiomorpholin-4-ylmethanone has a molecular weight of 283.40 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylphenyl)-thiomorpholin-4-ylmethanone is sourced from PubChem (CID 47227510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).