(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol

C16H25NO2 — CID 79669238

IUPAC(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol
SMILESCCCN1CCOC(C(O)c2cccc(C)c2C)C1
InChIInChI=1S/C16H25NO2/c1-4-8-17-9-10-19-15(11-17)16(18)14-7-5-6-12(2)13(14)3/h5-7,15-16,18H,4,8-11H2,1-3H3
InChIKeyKZOROPWQWKLRPR-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.45
Rot. Bonds4

About (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol

(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol (PubChem CID 79669238) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol
PubChem CID79669238
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol
SMILESCCCN1CCOC(C(O)c2cccc(C)c2C)C1
InChIInChI=1S/C16H25NO2/c1-4-8-17-9-10-19-15(11-17)16(18)14-7-5-6-12(2)13(14)3/h5-7,15-16,18H,4,8-11H2,1-3H3
InChIKeyKZOROPWQWKLRPR-UHFFFAOYSA-N
XLogP2.45
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-propylmorpholin-2-yl)-(3-propylphenyl)methanol
CID 116543720
2-(4-fluoro-2-methylphenyl)-1-(4-propylmorpholin-2-yl)ethanol
CID 114347522
1-(4-propylmorpholin-2-yl)pentan-1-ol
CID 79668705
1-(4-propylmorpholin-2-yl)hexan-1-ol
CID 79669554
(4-ethylmorpholin-2-yl)-(5-fluoro-2-methylphenyl)methanol
CID 79666863
1-(4-propylmorpholin-2-yl)undecan-1-ol
CID 79663521
phenyl-(4-propylmorpholin-2-yl)methanamine
CID 79657763
2-propan-2-yl-4-propylmorpholine
CID 58468712
(3-fluoro-4-methoxyphenyl)-(4-propylmorpholin-2-yl)methanol
CID 79669013
1-(3-bromo-2-fluorophenyl)-N-methyl-1-(4-propylmorpholin-2-yl)methanamine
CID 106645880
1-(2-ethoxyphenyl)-N-methyl-1-(4-propylmorpholin-2-yl)methanamine
CID 79663982
[(4-propylmorpholin-2-yl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105247926

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol?
The IUPAC name of (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol (CID 79669238) is (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol.
What is the SMILES notation for (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol?
The canonical SMILES for (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol is CCCN1CCOC(C(O)c2cccc(C)c2C)C1.
What is the InChIKey of (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol?
The InChIKey is KZOROPWQWKLRPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-8-17-9-10-19-15(11-17)16(18)14-7-5-6-12(2)13(14)3/h5-7,15-16,18H,4,8-11H2,1-3H3.
What are the key properties of (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol?
(2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol has a molecular weight of 263.38 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-(4-propylmorpholin-2-yl)methanol is sourced from PubChem (CID 79669238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).