2-(3-methylphenyl)morpholine;hydrochloride

C11H16ClNO — CID 71398912

IUPAC2-(3-methylphenyl)morpholine;hydrochloride
SMILESCc1cccc(C2CNCCO2)c1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-9-3-2-4-10(7-9)11-8-12-5-6-13-11;/h2-4,7,11-12H,5-6,8H2,1H3;1H
InChIKeyJYTAATTUJHIJKH-UHFFFAOYSA-N
MW213.71 g/mol
LogP2.08
Rot. Bonds1

About 2-(3-methylphenyl)morpholine;hydrochloride

2-(3-methylphenyl)morpholine;hydrochloride (PubChem CID 71398912) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is 2-(3-methylphenyl)morpholine;hydrochloride.

Molecular Properties

Compound Name2-(3-methylphenyl)morpholine;hydrochloride
PubChem CID71398912
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name2-(3-methylphenyl)morpholine;hydrochloride
SMILESCc1cccc(C2CNCCO2)c1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-9-3-2-4-10(7-9)11-8-12-5-6-13-11;/h2-4,7,11-12H,5-6,8H2,1H3;1H
InChIKeyJYTAATTUJHIJKH-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(3-methylphenyl)morpholine
CID 42182782
(2S)-2-(3-bromophenyl)morpholine
CID 28806253
2-(3,4-dimethylphenyl)morpholine
CID 43169342
2-[3-(1,1-difluoroethyl)phenyl]morpholine
CID 117326793
2-[3-(4,4-dimethylcyclohexyl)phenyl]morpholine
CID 117436588
azane;2-phenylmorpholine
CID 174664757
2-(3-chloro-5-methylphenyl)morpholine
CID 83703313
2-(3-bromo-4-methylphenyl)morpholine
CID 83730909
3-[(2R)-morpholin-2-yl]benzoic acid
CID 169449190
2-[3-(3-methoxyphenyl)phenyl]morpholine
CID 82092915
2-(2-fluoro-4-methylphenyl)morpholine
CID 83698750
(2R)-2-(4-fluoro-3-methylphenyl)morpholine
CID 94254202

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)morpholine;hydrochloride?
The IUPAC name of 2-(3-methylphenyl)morpholine;hydrochloride (CID 71398912) is 2-(3-methylphenyl)morpholine;hydrochloride.
What is the SMILES notation for 2-(3-methylphenyl)morpholine;hydrochloride?
The canonical SMILES for 2-(3-methylphenyl)morpholine;hydrochloride is Cc1cccc(C2CNCCO2)c1.Cl.
What is the InChIKey of 2-(3-methylphenyl)morpholine;hydrochloride?
The InChIKey is JYTAATTUJHIJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c1-9-3-2-4-10(7-9)11-8-12-5-6-13-11;/h2-4,7,11-12H,5-6,8H2,1H3;1H.
What are the key properties of 2-(3-methylphenyl)morpholine;hydrochloride?
2-(3-methylphenyl)morpholine;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)morpholine;hydrochloride is sourced from PubChem (CID 71398912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).