3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol

C16H25NO2 — CID 82105505

IUPAC3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol
SMILESCC(C)c1ccc(C(O)CCN2CCOCC2)cc1
InChIInChI=1S/C16H25NO2/c1-13(2)14-3-5-15(6-4-14)16(18)7-8-17-9-11-19-12-10-17/h3-6,13,16,18H,7-12H2,1-2H3
InChIKeyTVVYHJDMFMNVQI-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.57
Rot. Bonds5

About 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol

3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol (PubChem CID 82105505) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol
PubChem CID82105505
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol
SMILESCC(C)c1ccc(C(O)CCN2CCOCC2)cc1
InChIInChI=1S/C16H25NO2/c1-13(2)14-3-5-15(6-4-14)16(18)7-8-17-9-11-19-12-10-17/h3-6,13,16,18H,7-12H2,1-2H3
InChIKeyTVVYHJDMFMNVQI-UHFFFAOYSA-N
XLogP2.57
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-morpholin-4-yl-1-(4-phenylphenyl)propan-1-ol
CID 3039644
1-(4-butoxyphenyl)-3-morpholin-4-ylpropan-1-ol
CID 82073802
1-(4-fluorophenyl)-4-morpholin-4-ylbutan-1-ol
CID 4132449
4-[3-(4-propan-2-ylphenyl)propyl]morpholine
CID 146185786
3-(azepan-1-yl)-1-[4-[3-(azepan-1-yl)-1-hydroxypropyl]phenyl]propan-1-ol
CID 3774419
3-morpholin-4-yl-N-[1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 43205019
1-[4-(2-methylpropyl)phenyl]-3-pyrrolidin-1-ylpropan-1-ol
CID 112510765
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797
2-morpholin-4-yl-N-[(4-propan-2-ylphenyl)methyl]ethanamine;dihydrochloride
CID 2995241
4-[4-(1,4-oxazepan-4-yl)butan-2-yl]aniline
CID 113419983
N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide
CID 84560052
5-bromo-N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]furan-2-carboxamide
CID 84559000

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol?
The IUPAC name of 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol (CID 82105505) is 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol.
What is the SMILES notation for 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol?
The canonical SMILES for 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol is CC(C)c1ccc(C(O)CCN2CCOCC2)cc1.
What is the InChIKey of 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol?
The InChIKey is TVVYHJDMFMNVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-13(2)14-3-5-15(6-4-14)16(18)7-8-17-9-11-19-12-10-17/h3-6,13,16,18H,7-12H2,1-2H3.
What are the key properties of 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol?
3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol is sourced from PubChem (CID 82105505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).