N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide

C18H22N2O2S — CID 2634687

IUPACN-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NCCN1CCOCC1
InChIInChI=1S/C18H22N2O2S/c21-18(19-7-8-20-9-11-22-12-10-20)14-23-17-6-5-15-3-1-2-4-16(15)13-17/h1-6,13H,7-12,14H2,(H,19,21)
InChIKeyNUHZMNZCTKEGHF-UHFFFAOYSA-N
MW330.45 g/mol
LogP2.38
Rot. Bonds6

About N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide

N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide (PubChem CID 2634687) has the molecular formula C18H22N2O2S and a molecular weight of 330.45 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide
PubChem CID2634687
Molecular FormulaC18H22N2O2S
Molecular Weight330.45 g/mol
Exact Mass330.14
IUPAC NameN-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NCCN1CCOCC1
InChIInChI=1S/C18H22N2O2S/c21-18(19-7-8-20-9-11-22-12-10-20)14-23-17-6-5-15-3-1-2-4-16(15)13-17/h1-6,13H,7-12,14H2,(H,19,21)
InChIKeyNUHZMNZCTKEGHF-UHFFFAOYSA-N
XLogP2.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-naphthalen-2-ylsulfanyl-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119446088
2-(2-morpholin-4-ylethylamino)-1-naphthalen-2-ylethanone
CID 82101636
N-[2-(4-chlorophenyl)sulfanylethyl]-2-naphthalen-2-ylsulfanylacetamide
CID 7630379
5-[(2-naphthalen-2-ylsulfanylacetyl)amino]pentanoic acid
CID 119235112
N-(2-morpholin-4-ylethyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide
CID 1140896
N-(2-morpholin-4-ylethyl)benzo[e][1]benzofuran-2-carboxamide
CID 6460423
2-[(2-methylphenyl)methylsulfanyl]-N-(2-morpholin-4-ylethyl)acetamide
CID 2985571
2-(3,4-difluorophenyl)sulfanyl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 8926696
3-morpholin-4-yl-1-naphthalen-2-ylpropan-1-one
CID 2807050
2-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 17217479
2-(1,3-dioxoisoindol-2-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 4629546
2-(2-aminophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 16782251

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide (CID 2634687) is N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide is O=C(CSc1ccc2ccccc2c1)NCCN1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide?
The InChIKey is NUHZMNZCTKEGHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c21-18(19-7-8-20-9-11-22-12-10-20)14-23-17-6-5-15-3-1-2-4-16(15)13-17/h1-6,13H,7-12,14H2,(H,19,21).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide?
N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide has a molecular weight of 330.45 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-naphthalen-2-ylsulfanylacetamide is sourced from PubChem (CID 2634687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).