4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol

C14H23NO2S — CID 79045888

IUPAC4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol
SMILESCC(C)(C(O)CCc1ccsc1)N1CCOCC1
InChIInChI=1S/C14H23NO2S/c1-14(2,15-6-8-17-9-7-15)13(16)4-3-12-5-10-18-11-12/h5,10-11,13,16H,3-4,6-9H2,1-2H3
InChIKeyZOSIHVSOSUUZQY-UHFFFAOYSA-N
MW269.41 g/mol
LogP2.15
Rot. Bonds5

About 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol

4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol (PubChem CID 79045888) has the molecular formula C14H23NO2S and a molecular weight of 269.41 g/mol. Its IUPAC name is 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol.

Molecular Properties

Compound Name4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol
PubChem CID79045888
Molecular FormulaC14H23NO2S
Molecular Weight269.41 g/mol
Exact Mass269.14
IUPAC Name4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol
SMILESCC(C)(C(O)CCc1ccsc1)N1CCOCC1
InChIInChI=1S/C14H23NO2S/c1-14(2,15-6-8-17-9-7-15)13(16)4-3-12-5-10-18-11-12/h5,10-11,13,16H,3-4,6-9H2,1-2H3
InChIKeyZOSIHVSOSUUZQY-UHFFFAOYSA-N
XLogP2.15
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-dimethyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-amine
CID 79051611
4-methyl-4-morpholin-4-yl-1-phenylpentan-3-ol
CID 79045884
3-methyl-3-morpholin-4-yl-1-thiophen-3-ylpentan-2-ol
CID 79065174
N-ethyl-4-methyl-4-piperidin-1-yl-1-thiophen-3-ylpentan-3-amine
CID 79045793
4-ethyl-1-thiophen-3-ylhexane-3,4-diol
CID 103449392
4-methyl-1-phenyl-4-pyrrolidin-1-ylpentan-3-ol
CID 79056520
1-chloro-1,1-difluoro-4-thiophen-3-ylbutan-2-ol
CID 112575293
1-tert-butylsulfanyl-4-thiophen-3-ylbutan-2-ol
CID 65132704
1-(4-ethoxyoxan-4-yl)-3-thiophen-3-ylpropan-1-ol
CID 116754334
1-(3,4-dimethylphenyl)-3-methyl-3-morpholin-4-ylbutan-2-ol
CID 79045595
5-methyl-1-thiophen-3-ylhexane-3,4-diol
CID 103456568
(4-methyl-4-morpholin-4-yl-1-phenylpentan-3-yl)hydrazine
CID 105240046

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol?
The IUPAC name of 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol (CID 79045888) is 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol.
What is the SMILES notation for 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol?
The canonical SMILES for 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol is CC(C)(C(O)CCc1ccsc1)N1CCOCC1.
What is the InChIKey of 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol?
The InChIKey is ZOSIHVSOSUUZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2S/c1-14(2,15-6-8-17-9-7-15)13(16)4-3-12-5-10-18-11-12/h5,10-11,13,16H,3-4,6-9H2,1-2H3.
What are the key properties of 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol?
4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol has a molecular weight of 269.41 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-morpholin-4-yl-1-thiophen-3-ylpentan-3-ol is sourced from PubChem (CID 79045888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).