4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine

C25H28N2O3S — CID 149325736

IUPAC4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine
SMILESCCCC1C=C(c2cc3sccc3cn2)Oc2ccc(OCCN3CCOCC3)cc21
InChIInChI=1S/C25H28N2O3S/c1-2-3-18-14-24(22-16-25-19(17-26-22)6-13-31-25)30-23-5-4-20(15-21(18)23)29-12-9-27-7-10-28-11-8-27/h4-6,13-18H,2-3,7-12H2,1H3
InChIKeyYBIBXLQWFXSWKI-UHFFFAOYSA-N
MW436.58 g/mol
LogP5.32
Rot. Bonds7

About 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine

4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine (PubChem CID 149325736) has the molecular formula C25H28N2O3S and a molecular weight of 436.58 g/mol. Its IUPAC name is 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine
PubChem CID149325736
Molecular FormulaC25H28N2O3S
Molecular Weight436.58 g/mol
Exact Mass436.18
IUPAC Name4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine
SMILESCCCC1C=C(c2cc3sccc3cn2)Oc2ccc(OCCN3CCOCC3)cc21
InChIInChI=1S/C25H28N2O3S/c1-2-3-18-14-24(22-16-25-19(17-26-22)6-13-31-25)30-23-5-4-20(15-21(18)23)29-12-9-27-7-10-28-11-8-27/h4-6,13-18H,2-3,7-12H2,1H3
InChIKeyYBIBXLQWFXSWKI-UHFFFAOYSA-N
XLogP5.32
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.58
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine with MolForge

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Related Compounds

4-[4-(1-benzothiophen-6-yloxy)butyl]morpholine
CID 153402706
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
4-[4-[(5-butan-2-yl-1-benzothiophen-6-yl)oxy]butyl]morpholine
CID 146386383
4-[2-[(2-methyl-1-benzofuran-6-yl)oxy]ethyl]morpholine
CID 143026753
N-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1-[3-(2-morpholin-4-ylethoxy)phenyl]methanamine
CID 77097932
2-methyl-4-(2-morpholin-4-ylethoxy)-N-propylaniline
CID 90993901
4-[2-[4-(6-ethyl-3-pyridinyl)phenoxy]ethyl]morpholine
CID 59845977
4-[2-[8-(thiophen-2-ylmethoxy)phenazin-2-yl]oxyethyl]morpholine
CID 155191722
(NZ)-N-[6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethoxy]-2-thieno[3,2-c]pyridin-6-ylchromen-4-ylidene]hydroxylamine
CID 136503331
1-[5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-yl]ethanone
CID 90083469
ethyl 5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxylate
CID 18668888
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine?
The IUPAC name of 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine (CID 149325736) is 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine is CCCC1C=C(c2cc3sccc3cn2)Oc2ccc(OCCN3CCOCC3)cc21.
What is the InChIKey of 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine?
The InChIKey is YBIBXLQWFXSWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3S/c1-2-3-18-14-24(22-16-25-19(17-26-22)6-13-31-25)30-23-5-4-20(15-21(18)23)29-12-9-27-7-10-28-11-8-27/h4-6,13-18H,2-3,7-12H2,1H3.
What are the key properties of 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine?
4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine has a molecular weight of 436.58 g/mol, XLogP of 5.32, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine is sourced from PubChem (CID 149325736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).