5-methyl-2-(4-propan-2-ylphenyl)morpholine

C14H21NO — CID 43174769

IUPAC5-methyl-2-(4-propan-2-ylphenyl)morpholine
SMILESCC1COC(c2ccc(C(C)C)cc2)CN1
InChIInChI=1S/C14H21NO/c1-10(2)12-4-6-13(7-5-12)14-8-15-11(3)9-16-14/h4-7,10-11,14-15H,8-9H2,1-3H3
InChIKeyBQQFDIDLCHNVSJ-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.86
Rot. Bonds2

About 5-methyl-2-(4-propan-2-ylphenyl)morpholine

5-methyl-2-(4-propan-2-ylphenyl)morpholine (PubChem CID 43174769) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 5-methyl-2-(4-propan-2-ylphenyl)morpholine.

Molecular Properties

Compound Name5-methyl-2-(4-propan-2-ylphenyl)morpholine
PubChem CID43174769
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name5-methyl-2-(4-propan-2-ylphenyl)morpholine
SMILESCC1COC(c2ccc(C(C)C)cc2)CN1
InChIInChI=1S/C14H21NO/c1-10(2)12-4-6-13(7-5-12)14-8-15-11(3)9-16-14/h4-7,10-11,14-15H,8-9H2,1-3H3
InChIKeyBQQFDIDLCHNVSJ-UHFFFAOYSA-N
XLogP2.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,5S)-2-(4-fluorophenyl)-5-methylmorpholine;(5S)-2-(4-fluorophenyl)-5-methylmorpholine
CID 158378174
5-methyl-2-[4-(trifluoromethyl)phenyl]morpholine
CID 43367137
5-methyl-2-naphthalen-2-ylmorpholine
CID 43367075
2-(3-chloro-4-propan-2-yloxyphenyl)-5-methylmorpholine
CID 82305769
2-(3-bromo-4-fluorophenyl)-5-methylmorpholine
CID 62913908
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methylmorpholine
CID 43174749
2-(3,5-difluorophenyl)-5-methylmorpholine
CID 78021784
(2S,5S)-5-methyl-2-(3-methylphenyl)morpholine
CID 39238398
2-(4-bromophenyl)-5-propan-2-ylmorpholine
CID 79247039
3-chloro-N-[4-[(2S,5S)-5-methylmorpholin-2-yl]phenyl]benzamide
CID 58315548
2-(4-ethoxy-3-fluorophenyl)-5-methylmorpholine
CID 82292465
2-methyl-4-(4-propan-2-ylphenyl)azetidine
CID 116821931

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-propan-2-ylphenyl)morpholine?
The IUPAC name of 5-methyl-2-(4-propan-2-ylphenyl)morpholine (CID 43174769) is 5-methyl-2-(4-propan-2-ylphenyl)morpholine.
What is the SMILES notation for 5-methyl-2-(4-propan-2-ylphenyl)morpholine?
The canonical SMILES for 5-methyl-2-(4-propan-2-ylphenyl)morpholine is CC1COC(c2ccc(C(C)C)cc2)CN1.
What is the InChIKey of 5-methyl-2-(4-propan-2-ylphenyl)morpholine?
The InChIKey is BQQFDIDLCHNVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)12-4-6-13(7-5-12)14-8-15-11(3)9-16-14/h4-7,10-11,14-15H,8-9H2,1-3H3.
What are the key properties of 5-methyl-2-(4-propan-2-ylphenyl)morpholine?
5-methyl-2-(4-propan-2-ylphenyl)morpholine has a molecular weight of 219.33 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-propan-2-ylphenyl)morpholine is sourced from PubChem (CID 43174769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).