3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol

C114H114N8O9 — CID 160704532

IUPAC3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol
SMILESCOc1nc2cccc(C(O)(CCN(C)C)c3ccc4ccccc4c3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3cccc4ccccc34)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccccc3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccco3)c2cc1-c1ccccc1
InChIInChI=1S/2C31H30N2O2.C27H28N2O2.C25H26N2O3/c1-33(2)20-19-31(34,27-16-9-14-22-13-7-8-15-24(22)27)28-17-10-18-29-26(28)21-25(30(32-29)35-3)23-11-5-4-6-12-23;1-33(2)19-18-31(34,25-17-16-22-10-7-8-13-24(22)20-25)28-14-9-15-29-27(28)21-26(30(32-29)35-3)23-11-5-4-6-12-23;1-29(2)18-17-27(30,21-13-8-5-9-14-21)24-15-10-16-25-23(24)19-22(26(28-25)31-3)20-11-6-4-7-12-20;1-27(2)15-14-25(28,23-13-8-16-30-23)21-11-7-12-22-20(21)17-19(24(26-22)29-3)18-9-5-4-6-10-18/h4-18,21,34H,19-20H2,1-3H3;4-17,20-21,34H,18-19H2,1-3H3;4-16,19,30H,17-18H2,1-3H3;4-13,16-17,28H,14-15H2,1-3H3
InChIKeyRRAYFKDJXCEZRY-UHFFFAOYSA-N
MW1740.21 g/mol
LogP22.29
Rot. Bonds28

About 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol

3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol (PubChem CID 160704532) has the molecular formula C114H114N8O9 and a molecular weight of 1740.21 g/mol. Its IUPAC name is 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol
PubChem CID160704532
Molecular FormulaC114H114N8O9
Molecular Weight1740.21 g/mol
Exact Mass1738.87
IUPAC Name3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol
SMILESCOc1nc2cccc(C(O)(CCN(C)C)c3ccc4ccccc4c3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3cccc4ccccc34)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccccc3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccco3)c2cc1-c1ccccc1
InChIInChI=1S/2C31H30N2O2.C27H28N2O2.C25H26N2O3/c1-33(2)20-19-31(34,27-16-9-14-22-13-7-8-15-24(22)27)28-17-10-18-29-26(28)21-25(30(32-29)35-3)23-11-5-4-6-12-23;1-33(2)19-18-31(34,25-17-16-22-10-7-8-13-24(22)20-25)28-14-9-15-29-27(28)21-26(30(32-29)35-3)23-11-5-4-6-12-23;1-29(2)18-17-27(30,21-13-8-5-9-14-21)24-15-10-16-25-23(24)19-22(26(28-25)31-3)20-11-6-4-7-12-20;1-27(2)15-14-25(28,23-13-8-16-30-23)21-11-7-12-22-20(21)17-19(24(26-22)29-3)18-9-5-4-6-10-18/h4-18,21,34H,19-20H2,1-3H3;4-17,20-21,34H,18-19H2,1-3H3;4-16,19,30H,17-18H2,1-3H3;4-13,16-17,28H,14-15H2,1-3H3
InChIKeyRRAYFKDJXCEZRY-UHFFFAOYSA-N
XLogP22.29
TPSA195.50 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds28
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001740.21
LogP ≤ 522.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol with MolForge

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Launch Full Analysis

Related Compounds

2-(3,5-Difluoro-2-methylphenyl)-1-methylpyridin-1-ium;1-methyl-2-(1-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-6-phenylpyridin-1-ium;[4-methyl-5-(1-methylquinolin-1-ium-2-yl)furan-2-yl]methanol;[4-methyl-3-[1-methyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]phenyl]methyl formate
CID 158058096
3-Quinolineethanol, alpha-[2-(dimethylamino)ethyl]-6-[5-(hydroxymethyl)-2-furanyl]-2-methoxy-alpha-1-naphthalenyl-beta-phenyl-
CID 49767219
3-(Dimethylamino)-1-(furan-2-yl)-1-(2-methyl-4-phenylquinolin-6-yl)propan-1-ol
CID 58281422
3-(Dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-methylquinolin-6-yl)propan-1-ol
CID 58442708
(6S)-6-[(R)-[6-(furan-2-yl)-2-methoxyquinolin-3-yl]-phenylmethyl]-3-methyl-6-naphthalen-1-yl-1,3-oxazinane
CID 58853314
(6R)-6-(furan-2-yl)-6-[(R)-(2-methoxyquinolin-3-yl)-phenylmethyl]-3-methyl-1,3-oxazinane
CID 58853318
(6R)-6-[(R)-[6-(furan-2-yl)-2-methoxyquinolin-3-yl]-phenylmethyl]-3-methyl-6-naphthalen-1-yl-1,3-oxazinane
CID 58853330
(6S)-6-(furan-2-yl)-6-[(R)-(2-methoxyquinolin-3-yl)-phenylmethyl]-3-methyl-1,3-oxazinane
CID 58853339
1-(1-Benzofuran-2-yl)-3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol
CID 58857467
3-(Dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-4-phenylquinolin-6-yl)propan-1-ol
CID 58857473
3-(Dimethylamino)-1-(furan-2-yl)-1-(4-phenyl-2-pyridin-3-ylquinolin-6-yl)propan-1-ol
CID 58857511
3-(Dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol
CID 58857534

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol?
The IUPAC name of 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol (CID 160704532) is 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol.
What is the SMILES notation for 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol?
The canonical SMILES for 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol is COc1nc2cccc(C(O)(CCN(C)C)c3ccc4ccccc4c3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3cccc4ccccc34)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccccc3)c2cc1-c1ccccc1.COc1nc2cccc(C(O)(CCN(C)C)c3ccco3)c2cc1-c1ccccc1.
What is the InChIKey of 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol?
The InChIKey is RRAYFKDJXCEZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H30N2O2.C27H28N2O2.C25H26N2O3/c1-33(2)20-19-31(34,27-16-9-14-22-13-7-8-15-24(22)27)28-17-10-18-29-26(28)21-25(30(32-29)35-3)23-11-5-4-6-12-23;1-33(2)19-18-31(34,25-17-16-22-10-7-8-13-24(22)20-25)28-14-9-15-29-27(28)21-26(30(32-29)35-3)23-11-5-4-6-12-23;1-29(2)18-17-27(30,21-13-8-5-9-14-21)24-15-10-16-25-23(24)19-22(26(28-25)31-3)20-11-6-4-7-12-20;1-27(2)15-14-25(28,23-13-8-16-30-23)21-11-7-12-22-20(21)17-19(24(26-22)29-3)18-9-5-4-6-10-18/h4-18,21,34H,19-20H2,1-3H3;4-17,20-21,34H,18-19H2,1-3H3;4-16,19,30H,17-18H2,1-3H3;4-13,16-17,28H,14-15H2,1-3H3.
What are the key properties of 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol?
3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol has a molecular weight of 1740.21 g/mol, XLogP of 22.29, 28 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-(furan-2-yl)-1-(2-methoxy-3-phenylquinolin-5-yl)propan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-1-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-naphthalen-2-ylpropan-1-ol;3-(dimethylamino)-1-(2-methoxy-3-phenylquinolin-5-yl)-1-phenylpropan-1-ol is sourced from PubChem (CID 160704532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).