2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine

C15H20ClNO3 — CID 117479367

IUPAC2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine
SMILESCOc1cc(Cl)cc(C2CNCCO2)c1OC1CCC1
InChIInChI=1S/C15H20ClNO3/c1-18-13-8-10(16)7-12(14-9-17-5-6-19-14)15(13)20-11-3-2-4-11/h7-8,11,14,17H,2-6,9H2,1H3
InChIKeyDOIJHBKZNVCGNR-UHFFFAOYSA-N
MW297.78 g/mol
LogP2.94
Rot. Bonds4

About 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine

2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine (PubChem CID 117479367) has the molecular formula C15H20ClNO3 and a molecular weight of 297.78 g/mol. Its IUPAC name is 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine.

Molecular Properties

Compound Name2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine
PubChem CID117479367
Molecular FormulaC15H20ClNO3
Molecular Weight297.78 g/mol
Exact Mass297.11
IUPAC Name2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine
SMILESCOc1cc(Cl)cc(C2CNCCO2)c1OC1CCC1
InChIInChI=1S/C15H20ClNO3/c1-18-13-8-10(16)7-12(14-9-17-5-6-19-14)15(13)20-11-3-2-4-11/h7-8,11,14,17H,2-6,9H2,1H3
InChIKeyDOIJHBKZNVCGNR-UHFFFAOYSA-N
XLogP2.94
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.78
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine 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

2-(5-chloro-3-methoxy-2-methylphenyl)morpholine
CID 117356511
2-(5-chloro-2-cyclopentyloxy-3-methoxyphenyl)piperidine
CID 117494554
2-(2-chloro-4,5-dimethoxyphenyl)morpholine
CID 117397861
2-(5-fluoro-2,3-dimethoxyphenyl)morpholine
CID 117354893
2-(3-chloro-4,5-dimethoxy-2-propan-2-ylphenyl)morpholine
CID 117482760
2-(3-chloro-2-methoxy-4,5-dimethylphenyl)morpholine
CID 115004570
2-(6-chloro-2,3,4-trimethoxyphenyl)morpholine
CID 117464374
2-(5-chloro-4-methoxy-2-methylphenyl)morpholine
CID 82293184
2-(7-chloro-3-methoxynaphthalen-2-yl)morpholine
CID 117445267
5-chloro-2-cyclobutyloxy-3-methoxyphenol
CID 84692205
3-chloro-4,5-dimethoxy-2-morpholin-2-ylphenol
CID 117437042
2-(4-chloro-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl)morpholine
CID 117476546

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine?
The IUPAC name of 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine (CID 117479367) is 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine.
What is the SMILES notation for 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine?
The canonical SMILES for 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine is COc1cc(Cl)cc(C2CNCCO2)c1OC1CCC1.
What is the InChIKey of 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine?
The InChIKey is DOIJHBKZNVCGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO3/c1-18-13-8-10(16)7-12(14-9-17-5-6-19-14)15(13)20-11-3-2-4-11/h7-8,11,14,17H,2-6,9H2,1H3.
What are the key properties of 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine?
2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine has a molecular weight of 297.78 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-cyclobutyloxy-3-methoxyphenyl)morpholine is sourced from PubChem (CID 117479367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).