[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone

C14H19ClN2O3 — CID 81484092

IUPAC[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)N1CCOC(C(C)N)C1
InChIInChI=1S/C14H19ClN2O3/c1-9(16)13-8-17(5-6-20-13)14(18)11-7-10(15)3-4-12(11)19-2/h3-4,7,9,13H,5-6,8,16H2,1-2H3
InChIKeyMPNQRQSGPRMZDI-UHFFFAOYSA-N
MW298.77 g/mol
LogP1.54
Rot. Bonds3

About [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone

[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone (PubChem CID 81484092) has the molecular formula C14H19ClN2O3 and a molecular weight of 298.77 g/mol. Its IUPAC name is [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone.

Molecular Properties

Compound Name[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone
PubChem CID81484092
Molecular FormulaC14H19ClN2O3
Molecular Weight298.77 g/mol
Exact Mass298.11
IUPAC Name[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)N1CCOC(C(C)N)C1
InChIInChI=1S/C14H19ClN2O3/c1-9(16)13-8-17(5-6-20-13)14(18)11-7-10(15)3-4-12(11)19-2/h3-4,7,9,13H,5-6,8,16H2,1-2H3
InChIKeyMPNQRQSGPRMZDI-UHFFFAOYSA-N
XLogP1.54
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(1-aminoethyl)morpholin-4-yl]-(2-methoxy-5-methylphenyl)methanone
CID 81484012
[2-(1-aminoethyl)morpholin-4-yl]-(2-bromo-4-chlorophenyl)methanone
CID 103807821
[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-(2-chloro-4,5-difluorophenyl)methanone
CID 99716788
[2-(1-aminoethyl)morpholin-4-yl]-(3-bromo-4-methoxyphenyl)methanone
CID 81484800
[2-(1-aminoethyl)morpholin-4-yl]-(2-fluoro-4-methoxyphenyl)methanone
CID 103807823
[2-(1-aminoethyl)morpholin-4-yl]-(2-bromo-5-methoxyphenyl)methanone
CID 81484079
[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-(2,3-dichlorophenyl)methanone
CID 98010838
(5-chloro-2-methoxyphenyl)-[(3R)-3-methylsulfonylpyrrolidin-1-yl]methanone
CID 129373829
(3-aminoazetidin-1-yl)-(5-chloro-2-methoxyphenyl)methanone
CID 65244224
[2-(1-aminoethyl)morpholin-4-yl]-(2-chloro-4-fluorophenyl)methanone;hydrochloride
CID 86780110
[2-(1-aminoethyl)morpholin-4-yl]-(4-methoxyphenyl)methanone
CID 81484356
1-(5-chloro-2-methoxybenzoyl)piperidine-4-carboxamide
CID 2473565

Frequently Asked Questions

What is the IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone?
The IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone (CID 81484092) is [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone.
What is the SMILES notation for [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone?
The canonical SMILES for [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone is COc1ccc(Cl)cc1C(=O)N1CCOC(C(C)N)C1.
What is the InChIKey of [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone?
The InChIKey is MPNQRQSGPRMZDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3/c1-9(16)13-8-17(5-6-20-13)14(18)11-7-10(15)3-4-12(11)19-2/h3-4,7,9,13H,5-6,8,16H2,1-2H3.
What are the key properties of [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone?
[2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone has a molecular weight of 298.77 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-aminoethyl)morpholin-4-yl]-(5-chloro-2-methoxyphenyl)methanone is sourced from PubChem (CID 81484092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).