(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone

C13H16ClNO3 — CID 43613528

IUPAC(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone
SMILESCCC1COCCN1C(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H16ClNO3/c1-2-10-8-18-6-5-15(10)13(17)9-3-4-12(16)11(14)7-9/h3-4,7,10,16H,2,5-6,8H2,1H3
InChIKeyWFLQTAJAXFYYPE-UHFFFAOYSA-N
MW269.73 g/mol
LogP2.30
Rot. Bonds2

About (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone

(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone (PubChem CID 43613528) has the molecular formula C13H16ClNO3 and a molecular weight of 269.73 g/mol. Its IUPAC name is (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone
PubChem CID43613528
Molecular FormulaC13H16ClNO3
Molecular Weight269.73 g/mol
Exact Mass269.08
IUPAC Name(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone
SMILESCCC1COCCN1C(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H16ClNO3/c1-2-10-8-18-6-5-15(10)13(17)9-3-4-12(16)11(14)7-9/h3-4,7,10,16H,2,5-6,8H2,1H3
InChIKeyWFLQTAJAXFYYPE-UHFFFAOYSA-N
XLogP2.30
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.73
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-chloro-4-(3-hydroxyprop-1-ynyl)phenyl]-(3-ethylmorpholin-4-yl)methanone
CID 81290258
[3-(chloromethyl)morpholin-4-yl]-(4-hydroxy-3-methylphenyl)methanone
CID 107673227
2-[(3S)-4-(3-chloro-4-methylbenzoyl)morpholin-3-yl]acetic acid
CID 124572821
(3-ethylmorpholin-4-yl)-(1,2,3,4-tetrahydroquinoxalin-6-yl)methanone
CID 104614640
(2-chloro-6-ethyl-4-pyridinyl)-(3-ethylmorpholin-4-yl)methanone
CID 113379780
[4-(aminomethyl)phenyl]-(3-ethylmorpholin-4-yl)methanone
CID 43611605
(3-chloro-4-hydroxyphenyl)-(3-ethyl-4-methylpiperazin-1-yl)methanone
CID 55218173
(5-amino-2-chlorophenyl)-(3-ethylmorpholin-4-yl)methanone
CID 43611591
(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone
CID 55257874
[(3S)-3-ethylmorpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 70772603
(3-ethylmorpholin-4-yl)-(4-fluoro-3-nitrophenyl)methanone
CID 43613168
(6-bromo-3-pyridinyl)-(3-ethylmorpholin-4-yl)methanone
CID 66464852

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone?
The IUPAC name of (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone (CID 43613528) is (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone.
What is the SMILES notation for (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone?
The canonical SMILES for (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone is CCC1COCCN1C(=O)c1ccc(O)c(Cl)c1.
What is the InChIKey of (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone?
The InChIKey is WFLQTAJAXFYYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClNO3/c1-2-10-8-18-6-5-15(10)13(17)9-3-4-12(16)11(14)7-9/h3-4,7,10,16H,2,5-6,8H2,1H3.
What are the key properties of (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone?
(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone has a molecular weight of 269.73 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone is sourced from PubChem (CID 43613528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).