2-morpholin-4-yl-1-(4-propylphenyl)ethanone

C15H21NO2 — CID 43219458

IUPAC2-morpholin-4-yl-1-(4-propylphenyl)ethanone
SMILESCCCc1ccc(C(=O)CN2CCOCC2)cc1
InChIInChI=1S/C15H21NO2/c1-2-3-13-4-6-14(7-5-13)15(17)12-16-8-10-18-11-9-16/h4-7H,2-3,8-12H2,1H3
InChIKeyKCAFDUJIQBPZIS-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.15
Rot. Bonds5

About 2-morpholin-4-yl-1-(4-propylphenyl)ethanone

2-morpholin-4-yl-1-(4-propylphenyl)ethanone (PubChem CID 43219458) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-morpholin-4-yl-1-(4-propylphenyl)ethanone.

Molecular Properties

Compound Name2-morpholin-4-yl-1-(4-propylphenyl)ethanone
PubChem CID43219458
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-morpholin-4-yl-1-(4-propylphenyl)ethanone
SMILESCCCc1ccc(C(=O)CN2CCOCC2)cc1
InChIInChI=1S/C15H21NO2/c1-2-3-13-4-6-14(7-5-13)15(17)12-16-8-10-18-11-9-16/h4-7H,2-3,8-12H2,1H3
InChIKeyKCAFDUJIQBPZIS-UHFFFAOYSA-N
XLogP2.15
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-propylphenyl)-2-pyrrolidin-1-ylethanone
CID 43219358
2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(4-propylphenyl)ethanone
CID 62024063
1-(4-propylphenyl)-2-(1,4-thiazepan-4-yl)ethanone
CID 62030887
1-(4-bromophenyl)-2-morpholin-4-ylethanone;hydrochloride
CID 24747690
2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone
CID 62035423
1-(1-methylpyrrol-3-yl)-2-morpholin-4-ylethanone
CID 43227706
2-(4-methylpiperazin-1-yl)-1-(4-octylphenyl)ethanone
CID 170861609
1-(4-ethylphenyl)-2-pyrrolidin-1-ylethanone
CID 43219356
2-(3-ethyl-4-methylpiperazin-1-yl)-1-(4-propylphenyl)ethanone
CID 63633398
2-(1,3-dioxolan-2-yl)-1-(4-propylphenyl)ethanone
CID 66570608
2-(4-methylpiperazin-1-yl)-1-[4-[5-[4-[2-(4-methylpiperazin-1-yl)acetyl]phenyl]pentyl]phenyl]ethanone
CID 170861790
1-(3-amino-4-chlorophenyl)-2-morpholin-4-ylethanone
CID 82482111

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-1-(4-propylphenyl)ethanone?
The IUPAC name of 2-morpholin-4-yl-1-(4-propylphenyl)ethanone (CID 43219458) is 2-morpholin-4-yl-1-(4-propylphenyl)ethanone.
What is the SMILES notation for 2-morpholin-4-yl-1-(4-propylphenyl)ethanone?
The canonical SMILES for 2-morpholin-4-yl-1-(4-propylphenyl)ethanone is CCCc1ccc(C(=O)CN2CCOCC2)cc1.
What is the InChIKey of 2-morpholin-4-yl-1-(4-propylphenyl)ethanone?
The InChIKey is KCAFDUJIQBPZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-2-3-13-4-6-14(7-5-13)15(17)12-16-8-10-18-11-9-16/h4-7H,2-3,8-12H2,1H3.
What are the key properties of 2-morpholin-4-yl-1-(4-propylphenyl)ethanone?
2-morpholin-4-yl-1-(4-propylphenyl)ethanone has a molecular weight of 247.34 g/mol, XLogP of 2.15, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-1-(4-propylphenyl)ethanone is sourced from PubChem (CID 43219458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).