2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one

C14H19NO2 — CID 155346145

IUPAC2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one
SMILESCCN(CC)C1C(=O)C1c1ccccc1OC
InChIInChI=1S/C14H19NO2/c1-4-15(5-2)13-12(14(13)16)10-8-6-7-9-11(10)17-3/h6-9,12-13H,4-5H2,1-3H3
InChIKeyPLLRDSZZWHXGNW-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.07
Rot. Bonds5

About 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one

2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one (PubChem CID 155346145) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one.

Molecular Properties

Compound Name2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one
PubChem CID155346145
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one
SMILESCCN(CC)C1C(=O)C1c1ccccc1OC
InChIInChI=1S/C14H19NO2/c1-4-15(5-2)13-12(14(13)16)10-8-6-7-9-11(10)17-3/h6-9,12-13H,4-5H2,1-3H3
InChIKeyPLLRDSZZWHXGNW-UHFFFAOYSA-N
XLogP2.07
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-N,N-diethyl-3-(2-methoxyphenyl)oxirane-2-carboxamide
CID 56601477
3-tert-butyl-4-(2-methoxyphenyl)oxolane-2,5-dione
CID 102002061
4-hydroxy-3-(2-methoxyphenyl)-1-propan-2-ylpyrrolidin-2-one
CID 118535332
(3S,4S)-4-(hydroxymethyl)-3-(2-methoxyphenyl)oxolan-2-one
CID 125476085
1-ethyl-4-(2-methoxyphenyl)-3,3-dimethylazetidin-2-one
CID 90667223
ethane;3-(2-methoxyphenyl)-3H-1-benzofuran-2-one
CID 91371592
ethyl 1-amino-2-(2-methoxyphenyl)cyclopropane-1-carboxylate
CID 82363625
2-[cyclopropyl(ethyl)amino]-1-(2-methoxyphenyl)ethanone
CID 43794992
(5S)-5-(2-methoxyphenyl)-3,3-dimethyloxolan-2-one
CID 155935569
1-cyclopropyl-2-methoxybenzene;ethane
CID 144769798
9-(2-methoxyphenyl)-9H-fluorene
CID 10492416
(2R,6S,7S,9S,13S,14S)-4,11-diethyl-7,14-bis(2-methoxyphenyl)-1,4,8,11-tetrazatetracyclo[6.6.0.02,6.09,13]tetradecane-3,5,10,12-tetrone
CID 124823036

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one?
The IUPAC name of 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one (CID 155346145) is 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one.
What is the SMILES notation for 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one?
The canonical SMILES for 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one is CCN(CC)C1C(=O)C1c1ccccc1OC.
What is the InChIKey of 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one?
The InChIKey is PLLRDSZZWHXGNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-4-15(5-2)13-12(14(13)16)10-8-6-7-9-11(10)17-3/h6-9,12-13H,4-5H2,1-3H3.
What are the key properties of 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one?
2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one has a molecular weight of 233.31 g/mol, XLogP of 2.07, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-3-(2-methoxyphenyl)cyclopropan-1-one is sourced from PubChem (CID 155346145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).