ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone

C18H23NO2 — CID 143890558

IUPACethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone
SMILESCC.Cc1ccc2cc(C(=O)N3CCOCC3)ccc2c1
InChIInChI=1S/C16H17NO2.C2H6/c1-12-2-3-14-11-15(5-4-13(14)10-12)16(18)17-6-8-19-9-7-17;1-2/h2-5,10-11H,6-9H2,1H3;1-2H3
InChIKeyZTERYMWEVDVCQN-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.65
Rot. Bonds1

About ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone

ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone (PubChem CID 143890558) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Nameethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone
PubChem CID143890558
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Nameethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone
SMILESCC.Cc1ccc2cc(C(=O)N3CCOCC3)ccc2c1
InChIInChI=1S/C16H17NO2.C2H6/c1-12-2-3-14-11-15(5-4-13(14)10-12)16(18)17-6-8-19-9-7-17;1-2/h2-5,10-11H,6-9H2,1H3;1-2H3
InChIKeyZTERYMWEVDVCQN-UHFFFAOYSA-N
XLogP3.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(4-methylphenyl)-morpholin-4-ylmethanone;propane
CID 176553137
[1-[(4-methylphenyl)methyl]indazol-6-yl]-morpholin-4-ylmethanone
CID 53012811
(4-bromo-3-methylphenyl)-morpholin-4-ylmethanone
CID 18960596
(3,4-dimethylphenyl)-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110365079
ethane;(2-fluoro-5-methylphenyl)-morpholin-4-ylmethanone
CID 145081702
(5-methyl-1H-indol-2-yl)-morpholin-4-ylmethanone
CID 4210929
[4-(4-methoxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 3530238
(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone
CID 154827558
[4-(3-methylphenyl)piperazin-1-yl]-[3-(morpholine-4-carbonyl)phenyl]methanone
CID 109052867
[3-[(2,5-dimethylphenyl)methoxy]phenyl]-morpholin-4-ylmethanone
CID 13176465
N-(2,4-dimethylphenyl)-3-(morpholine-4-carbonyl)benzamide
CID 109052893
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615

Frequently Asked Questions

What is the IUPAC name of ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone (CID 143890558) is ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone is CC.Cc1ccc2cc(C(=O)N3CCOCC3)ccc2c1.
What is the InChIKey of ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone?
The InChIKey is ZTERYMWEVDVCQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2.C2H6/c1-12-2-3-14-11-15(5-4-13(14)10-12)16(18)17-6-8-19-9-7-17;1-2/h2-5,10-11H,6-9H2,1H3;1-2H3.
What are the key properties of ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone?
ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone has a molecular weight of 285.39 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 143890558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).