4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride

C66H105Cl6FN12O8Sn — CID 167552976

IUPAC4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride
SMILESC=C(OCC)[Sn](CCCC)(CCCC)CCCC.C=C(OCC)c1cc(Cl)cc(N2CCOCC2)n1.CC(=O)c1cc(Cl)cc(N2CCOCC2)n1.CF.CN(C)/C=C/C(=O)c1cc(Cl)cc(N2CCOCC2)n1.Cl.Clc1cc(Cl)nc(N2CCOCC2)c1.[2H]C.[H]N=C(N)N
InChIInChI=1S/C14H18ClN3O2.C13H17ClN2O2.C11H13ClN2O2.C9H10Cl2N2O.C4H7O.3C4H9.CH3F.CH5N3.CH4.ClH.Sn/c1-17(2)4-3-13(19)12-9-11(15)10-14(16-12)18-5-7-20-8-6-18;1-3-18-10(2)12-8-11(14)9-13(15-12)16-4-6-17-7-5-16;1-8(15)10-6-9(12)7-11(13-10)14-2-4-16-5-3-14;10-7-5-8(11)12-9(6-7)13-1-3-14-4-2-13;1-3-5-4-2;3*1-3-4-2;1-2;2-1(3)4;;;/h3-4,9-10H,5-8H2,1-2H3;8-9H,2-7H2,1H3;6-7H,2-5H2,1H3;5-6H,1-4H2;1,4H2,2H3;3*1,3-4H2,2H3;1H3;(H5,2,3,4);1H4;1H;/b4-3+;;;;;;;;;;;;/i;;;;;;;;;;1D;;
InChIKeyCHPKGHDCAGHBFI-AZZARXTNSA-N
MW1546.08 g/mol
LogP14.81
Rot. Bonds23

About 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride

4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride (PubChem CID 167552976) has the molecular formula C66H105Cl6FN12O8Sn and a molecular weight of 1546.08 g/mol. Its IUPAC name is 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride.

Molecular Properties

Compound Name4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride
PubChem CID167552976
Molecular FormulaC66H105Cl6FN12O8Sn
Molecular Weight1546.08 g/mol
Exact Mass1543.54
IUPAC Name4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride
SMILESC=C(OCC)[Sn](CCCC)(CCCC)CCCC.C=C(OCC)c1cc(Cl)cc(N2CCOCC2)n1.CC(=O)c1cc(Cl)cc(N2CCOCC2)n1.CF.CN(C)/C=C/C(=O)c1cc(Cl)cc(N2CCOCC2)n1.Cl.Clc1cc(Cl)nc(N2CCOCC2)c1.[2H]C.[H]N=C(N)N
InChIInChI=1S/C14H18ClN3O2.C13H17ClN2O2.C11H13ClN2O2.C9H10Cl2N2O.C4H7O.3C4H9.CH3F.CH5N3.CH4.ClH.Sn/c1-17(2)4-3-13(19)12-9-11(15)10-14(16-12)18-5-7-20-8-6-18;1-3-18-10(2)12-8-11(14)9-13(15-12)16-4-6-17-7-5-16;1-8(15)10-6-9(12)7-11(13-10)14-2-4-16-5-3-14;10-7-5-8(11)12-9(6-7)13-1-3-14-4-2-13;1-3-5-4-2;3*1-3-4-2;1-2;2-1(3)4;;;/h3-4,9-10H,5-8H2,1-2H3;8-9H,2-7H2,1H3;6-7H,2-5H2,1H3;5-6H,1-4H2;1,4H2,2H3;3*1,3-4H2,2H3;1H3;(H5,2,3,4);1H4;1H;/b4-3+;;;;;;;;;;;;/i;;;;;;;;;;1D;;
InChIKeyCHPKGHDCAGHBFI-AZZARXTNSA-N
XLogP14.81
TPSA233.17 Ų
H-Bond Donors3
H-Bond Acceptors18
Rotatable Bonds23
Heavy Atoms94
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001546.08
LogP ≤ 514.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-(4,4-difluorocyclohexyl)-4-morpholin-4-ylpyridin-2-amine;4-(2,6-dichloro-4-pyridinyl)morpholine;4,4-difluorocyclohexan-1-amine;(E)-1-[6-[(4,4-difluorocyclohexyl)amino]-4-morpholin-4-yl-2-pyridinyl]-3-(dimethylamino)prop-2-en-1-one;1-[6-[(4,4-difluorocyclohexyl)amino]-4-morpholin-4-yl-2-pyridinyl]ethanone;N-(4,4-difluorocyclohexyl)-6-(1-ethoxyethenyl)-4-morpholin-4-ylpyridin-2-amine;N-(4,4-difluorocyclohexyl)-6-(2-methylpyrimidin-4-yl)-4-morpholin-4-ylpyridin-2-amine;ethanimidamide;tributyl(prop-1-en-2-yl)stannane;hydrochloride
CID 158004313
Methyl 4-chloro-6-morpholin-4-ylpyridine-2-carboxylate;methyl 6-chloro-4-morpholin-4-ylpyridine-2-carboxylate;methyl 4,6-dichloropyridine-2-carboxylate
CID 159863054
2-Bromo-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine
CID 164998564
4-[4-Chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone
CID 165070873
Carbon dioxide;2,4-dichloro-6-methylpyridine;methyl 4-chloro-6-morpholin-4-ylpyridine-2-carboxylate;morpholine
CID 167623263
(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;fluoromethane
CID 167697734

Frequently Asked Questions

What is the IUPAC name of 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride?
The IUPAC name of 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride (CID 167552976) is 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride.
What is the SMILES notation for 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride?
The canonical SMILES for 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride is C=C(OCC)[Sn](CCCC)(CCCC)CCCC.C=C(OCC)c1cc(Cl)cc(N2CCOCC2)n1.CC(=O)c1cc(Cl)cc(N2CCOCC2)n1.CF.CN(C)/C=C/C(=O)c1cc(Cl)cc(N2CCOCC2)n1.Cl.Clc1cc(Cl)nc(N2CCOCC2)c1.[2H]C.[H]N=C(N)N.
What is the InChIKey of 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride?
The InChIKey is CHPKGHDCAGHBFI-AZZARXTNSA-N. The full InChI is InChI=1S/C14H18ClN3O2.C13H17ClN2O2.C11H13ClN2O2.C9H10Cl2N2O.C4H7O.3C4H9.CH3F.CH5N3.CH4.ClH.Sn/c1-17(2)4-3-13(19)12-9-11(15)10-14(16-12)18-5-7-20-8-6-18;1-3-18-10(2)12-8-11(14)9-13(15-12)16-4-6-17-7-5-16;1-8(15)10-6-9(12)7-11(13-10)14-2-4-16-5-3-14;10-7-5-8(11)12-9(6-7)13-1-3-14-4-2-13;1-3-5-4-2;3*1-3-4-2;1-2;2-1(3)4;;;/h3-4,9-10H,5-8H2,1-2H3;8-9H,2-7H2,1H3;6-7H,2-5H2,1H3;5-6H,1-4H2;1,4H2,2H3;3*1,3-4H2,2H3;1H3;(H5,2,3,4);1H4;1H;/b4-3+;;;;;;;;;;;;/i;;;;;;;;;;1D;;.
What are the key properties of 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride?
4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride has a molecular weight of 1546.08 g/mol, XLogP of 14.81, 23 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-chloro-6-(1-ethoxyethenyl)-2-pyridinyl]morpholine;(E)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-(dimethylamino)prop-2-en-1-one;1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone;deuteriomethane;4-(4,6-dichloro-2-pyridinyl)morpholine;fluoromethane;guanidine;tributyl(1-ethoxyethenyl)stannane;hydrochloride is sourced from PubChem (CID 167552976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).