3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine

C31H30N4O2S — CID 141098916

IUPAC3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
SMILESc1ccc(C2(c3ccc4ccccc4n3)OCCN(N3CCCCC3)C2(c2ccco2)c2cccs2)nc1
InChIInChI=1S/C31H30N4O2S/c1-6-18-34(19-7-1)35-20-22-37-31(26-12-4-5-17-32-26,27-16-15-24-10-2-3-11-25(24)33-27)30(35,28-13-8-21-36-28)29-14-9-23-38-29/h2-5,8-17,21,23H,1,6-7,18-20,22H2
InChIKeyKFDZZKLMELHITJ-UHFFFAOYSA-N
MW522.67 g/mol
LogP6.20
Rot. Bonds5

About 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine

3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine (PubChem CID 141098916) has the molecular formula C31H30N4O2S and a molecular weight of 522.67 g/mol. Its IUPAC name is 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine.

Molecular Properties

Compound Name3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
PubChem CID141098916
Molecular FormulaC31H30N4O2S
Molecular Weight522.67 g/mol
Exact Mass522.21
IUPAC Name3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
SMILESc1ccc(C2(c3ccc4ccccc4n3)OCCN(N3CCCCC3)C2(c2ccco2)c2cccs2)nc1
InChIInChI=1S/C31H30N4O2S/c1-6-18-34(19-7-1)35-20-22-37-31(26-12-4-5-17-32-26,27-16-15-24-10-2-3-11-25(24)33-27)30(35,28-13-8-21-36-28)29-14-9-23-38-29/h2-5,8-17,21,23H,1,6-7,18-20,22H2
InChIKeyKFDZZKLMELHITJ-UHFFFAOYSA-N
XLogP6.20
TPSA54.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.67
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine with MolForge

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Launch Full Analysis

Related Compounds

2-(Furan-2-yl)-6-pyridin-4-yl-4-thiophen-2-ylpyridine
CID 44423803
2-(Furan-2-yl)-6-pyridin-4-yl-4-thiophen-3-ylpyridine
CID 44423806
2-[3-(Furan-2-yl)-5-thiophen-2-yl-4-pyridinyl]quinoline
CID 54311171
2-[8-(Furan-2-yl)-3-pyridin-2-yl-2-thiophen-2-ylnaphthalen-1-yl]quinoline
CID 54326698
1-[2-(Cyclohexen-1-yl)-2-cyclohexyl-5-(furan-2-yl)-1-quinolin-2-yl-5-thiophen-2-ylcyclopentyl]isoquinoline
CID 140991969
1-[5-(Furan-2-yl)-3-phenoxy-4-phenyl-3-pyridazin-3-yl-2-quinolin-2-yl-6-thiophen-2-ylcyclohexa-1,5-dien-1-yl]isoquinoline
CID 141008276
3-(Furan-2-yl)-4-piperidin-1-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
CID 141073613
5-(Furan-2-yl)-3-pyridin-2-yl-1-quinolin-2-yl-4-thiophen-2-ylisoquinoline
CID 141093869
2-[6-(furan-2-yl)-2-pyridin-2-yl-4-(1H-pyrrol-2-yl)-5-thiophen-2-yl-3-pyridinyl]quinoline
CID 141095880
4-(Furan-2-yl)-5-naphthalen-1-yl-6-phenyl-2-pyridin-2-yl-3-thiophen-2-ylquinoline
CID 141209653
3-(furan-2-yl)-6-(1H-imidazol-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
CID 141281768
2-(Furan-2-yl)-4-phenyl-3-thiophen-2-ylpyridine
CID 141405226

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine?
The IUPAC name of 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine (CID 141098916) is 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine.
What is the SMILES notation for 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine?
The canonical SMILES for 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine is c1ccc(C2(c3ccc4ccccc4n3)OCCN(N3CCCCC3)C2(c2ccco2)c2cccs2)nc1.
What is the InChIKey of 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine?
The InChIKey is KFDZZKLMELHITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H30N4O2S/c1-6-18-34(19-7-1)35-20-22-37-31(26-12-4-5-17-32-26,27-16-15-24-10-2-3-11-25(24)33-27)30(35,28-13-8-21-36-28)29-14-9-23-38-29/h2-5,8-17,21,23H,1,6-7,18-20,22H2.
What are the key properties of 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine?
3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine has a molecular weight of 522.67 g/mol, XLogP of 6.20, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine is sourced from PubChem (CID 141098916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).