1-morpholin-4-yl-2-naphthalen-1-ylethanone

C16H17NO2 — CID 2877977

IUPAC1-morpholin-4-yl-2-naphthalen-1-ylethanone
SMILESO=C(Cc1cccc2ccccc12)N1CCOCC1
InChIInChI=1S/C16H17NO2/c18-16(17-8-10-19-11-9-17)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7H,8-12H2
InChIKeyZZUPFXNFWJEDBR-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.24
Rot. Bonds2

About 1-morpholin-4-yl-2-naphthalen-1-ylethanone

1-morpholin-4-yl-2-naphthalen-1-ylethanone (PubChem CID 2877977) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-naphthalen-1-ylethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-naphthalen-1-ylethanone
PubChem CID2877977
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name1-morpholin-4-yl-2-naphthalen-1-ylethanone
SMILESO=C(Cc1cccc2ccccc12)N1CCOCC1
InChIInChI=1S/C16H17NO2/c18-16(17-8-10-19-11-9-17)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7H,8-12H2
InChIKeyZZUPFXNFWJEDBR-UHFFFAOYSA-N
XLogP2.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-naphthalen-1-ylethanone?
The IUPAC name of 1-morpholin-4-yl-2-naphthalen-1-ylethanone (CID 2877977) is 1-morpholin-4-yl-2-naphthalen-1-ylethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-naphthalen-1-ylethanone?
The canonical SMILES for 1-morpholin-4-yl-2-naphthalen-1-ylethanone is O=C(Cc1cccc2ccccc12)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-naphthalen-1-ylethanone?
The InChIKey is ZZUPFXNFWJEDBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-16(17-8-10-19-11-9-17)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7H,8-12H2.
What are the key properties of 1-morpholin-4-yl-2-naphthalen-1-ylethanone?
1-morpholin-4-yl-2-naphthalen-1-ylethanone has a molecular weight of 255.32 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-naphthalen-1-ylethanone is sourced from PubChem (CID 2877977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).