(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone

C14H17NO2 — CID 154827558

IUPAC(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone
SMILESC=Cc1cc(C(=O)N2CCOCC2)ccc1C
InChIInChI=1S/C14H17NO2/c1-3-12-10-13(5-4-11(12)2)14(16)15-6-8-17-9-7-15/h3-5,10H,1,6-9H2,2H3
InChIKeyCECTVFPPOOCYCJ-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.11
Rot. Bonds2

About (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone

(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone (PubChem CID 154827558) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone
PubChem CID154827558
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone
SMILESC=Cc1cc(C(=O)N2CCOCC2)ccc1C
InChIInChI=1S/C14H17NO2/c1-3-12-10-13(5-4-11(12)2)14(16)15-6-8-17-9-7-15/h3-5,10H,1,6-9H2,2H3
InChIKeyCECTVFPPOOCYCJ-UHFFFAOYSA-N
XLogP2.11
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-dimethylphenyl)-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110365079
(4-bromo-3-methylphenyl)-morpholin-4-ylmethanone
CID 18960596
(3-amino-4-methylphenyl)-(1,4-oxazepan-4-yl)methanone
CID 55151996
ethane;(6-methylnaphthalen-2-yl)-morpholin-4-ylmethanone
CID 143890558
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
[3-(morpholine-4-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109051623
N-(2,6-dimethylphenyl)-3-(morpholine-4-carbonyl)benzamide
CID 109052897
[3-(3-aminoprop-1-ynyl)-4-methylphenyl]-morpholin-4-ylmethanone
CID 81476214
[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38491417
ethane;(4-methylphenyl)-morpholin-4-ylmethanone;propane
CID 176553137
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615
morpholin-4-yl-(3-morpholin-4-ylphenyl)methanone
CID 22057964

Frequently Asked Questions

What is the IUPAC name of (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone?
The IUPAC name of (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone (CID 154827558) is (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone is C=Cc1cc(C(=O)N2CCOCC2)ccc1C.
What is the InChIKey of (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone?
The InChIKey is CECTVFPPOOCYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-3-12-10-13(5-4-11(12)2)14(16)15-6-8-17-9-7-15/h3-5,10H,1,6-9H2,2H3.
What are the key properties of (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone?
(3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone has a molecular weight of 231.30 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethenyl-4-methylphenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 154827558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).