methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane

C59H71ClN12O5Sn — CID 158733748

IUPACmethyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccccn1.COC(=O)c1cc(-c2ccccn2)c(C)cn1.COC(=O)c1cc(Cl)c(C)cn1.Cc1cnc(C(=O)Nc2cccc(-c3nnnn3C(C)C)n2)cc1-c1ccccn1
InChIInChI=1S/C21H20N8O.C13H12N2O2.C8H8ClNO2.C5H4N.3C4H9.Sn/c1-13(2)29-20(26-27-28-29)17-8-6-9-19(24-17)25-21(30)18-11-15(14(3)12-23-18)16-7-4-5-10-22-16;1-9-8-15-12(13(16)17-2)7-10(9)11-5-3-4-6-14-11;1-5-4-10-7(3-6(5)9)8(11)12-2;1-2-4-6-5-3-1;3*1-3-4-2;/h4-13H,1-3H3,(H,24,25,30);3-8H,1-2H3;3-4H,1-2H3;1-4H;3*1,3-4H2,2H3;
InChIKeyILKKSGDGBJFPDC-UHFFFAOYSA-N
MW1182.46 g/mol
LogP12.54
Rot. Bonds18

About methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane

methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane (PubChem CID 158733748) has the molecular formula C59H71ClN12O5Sn and a molecular weight of 1182.46 g/mol. Its IUPAC name is methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane.

Molecular Properties

Compound Namemethyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane
PubChem CID158733748
Molecular FormulaC59H71ClN12O5Sn
Molecular Weight1182.46 g/mol
Exact Mass1182.44
IUPAC Namemethyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccccn1.COC(=O)c1cc(-c2ccccn2)c(C)cn1.COC(=O)c1cc(Cl)c(C)cn1.Cc1cnc(C(=O)Nc2cccc(-c3nnnn3C(C)C)n2)cc1-c1ccccn1
InChIInChI=1S/C21H20N8O.C13H12N2O2.C8H8ClNO2.C5H4N.3C4H9.Sn/c1-13(2)29-20(26-27-28-29)17-8-6-9-19(24-17)25-21(30)18-11-15(14(3)12-23-18)16-7-4-5-10-22-16;1-9-8-15-12(13(16)17-2)7-10(9)11-5-3-4-6-14-11;1-5-4-10-7(3-6(5)9)8(11)12-2;1-2-4-6-5-3-1;3*1-3-4-2;/h4-13H,1-3H3,(H,24,25,30);3-8H,1-2H3;3-4H,1-2H3;1-4H;3*1,3-4H2,2H3;
InChIKeyILKKSGDGBJFPDC-UHFFFAOYSA-N
XLogP12.54
TPSA215.53 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds18
Heavy Atoms78
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001182.46
LogP ≤ 512.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Analyze methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane with MolForge

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Launch Full Analysis

Related Compounds

5-[3-[2-Chloro-5-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-6-methoxycarbonyl-3-pyridinyl]propyl]-3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 167013242
(4-(8-(5-(4-(Oxetan-3-yl)piperazin-1-yl)pyridin-2-ylamino)[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-(1-oxo-3,4,6,7,8,9-hexahydropyrazino[1,2-a]indol-2(1H)-yl)pyridin-3-yl)methyl Acetate
CID 86684162
pyridin-2-ylmethyl (9R,14S)-14-[[(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoyl]amino]-5-(2-methoxy-2-oxoethyl)-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(19),2(7),3,5,15,17-hexaene-9-carboxylate
CID 152870936
(9S)-5-chloro-N-pyrazin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(2-methoxycarbonyl-4-pyridinyl)boronic acid;methyl 4-[(9S)-8-(pyrazin-2-ylcarbamoyl)-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-5-yl]pyridine-2-carboxylate
CID 157075281
4-(1-cyclopropylpyrazol-4-yl)-5-(difluoromethyl)-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]pyridine-2-carboxamide;methyl 4-chloro-5-(difluoromethyl)pyridine-2-carboxylate;methyl 4-(1-cyclopropylpyrazol-4-yl)-5-(difluoromethyl)pyridine-2-carboxylate
CID 157644637
methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-3-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-3-ylpyridine-2-carboxamide;pyridin-2-ylboronic acid
CID 157746240
(2R)-2-[5-(6-amino-2-pyridinyl)-2H-tetrazol-1-ium-1-yl]propan-1-ol;4-bromo-2-chloro-5-methylpyridine;1-bromo-3-methylcyclobutane;2-chloro-5-methyl-4-(3-methylcyclobutyl)pyridine;ethyl 5-methyl-4-(3-methylcyclobutyl)pyridine-2-carboxylate;N-[6-[1-[(2R)-1-hydroxypropan-2-yl]-2H-tetrazol-1-ium-5-yl]-2-pyridinyl]-5-methyl-4-(3-methylcyclobutyl)pyridine-2-carboxamide;methane;3-methylcyclobutan-1-ol
CID 158935779
(4-chloro-3-fluorophenyl)-[4-[(2S)-2-ethyl-4-[2-methyl-6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]piperazin-1-yl]piperidin-1-yl]methanone;methyl 5-[(3S)-4-[1-(4-chloro-3-fluorobenzoyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-methylpyridine-2-carboxylate
CID 158945416
methyl 4-chloro-5-methylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-4-ylpyridine-2-carboxamide;5-methyl-4-pyridin-4-ylpyridine-2-carboxylic acid;pyridin-4-ylboronic acid
CID 161015606
ethyl 5-methyl-4-pyridin-3-ylpyridine-2-carboxylate;N-[6-[1-(1-hydroxypropan-2-yl)tetrazol-5-yl]-2-pyridinyl]-5-methyl-4-pyridin-3-ylpyridine-2-carboxamide;methane
CID 162113691
2-O-tert-butyl 7-O-ethyl 3,4-dihydro-1H-2,6-naphthyridine-2,7-dicarboxylate;tert-butyl 7-[[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]carbamoyl]-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylate;6-(4-propan-2-yl-1,2,4-triazol-3-yl)pyridin-2-amine
CID 162215264
methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;bis(5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide);tributyl(pyridin-2-yl)stannane
CID 164996849

Frequently Asked Questions

What is the IUPAC name of methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane?
The IUPAC name of methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane (CID 158733748) is methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane.
What is the SMILES notation for methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane?
The canonical SMILES for methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1ccccn1.COC(=O)c1cc(-c2ccccn2)c(C)cn1.COC(=O)c1cc(Cl)c(C)cn1.Cc1cnc(C(=O)Nc2cccc(-c3nnnn3C(C)C)n2)cc1-c1ccccn1.
What is the InChIKey of methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane?
The InChIKey is ILKKSGDGBJFPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N8O.C13H12N2O2.C8H8ClNO2.C5H4N.3C4H9.Sn/c1-13(2)29-20(26-27-28-29)17-8-6-9-19(24-17)25-21(30)18-11-15(14(3)12-23-18)16-7-4-5-10-22-16;1-9-8-15-12(13(16)17-2)7-10(9)11-5-3-4-6-14-11;1-5-4-10-7(3-6(5)9)8(11)12-2;1-2-4-6-5-3-1;3*1-3-4-2;/h4-13H,1-3H3,(H,24,25,30);3-8H,1-2H3;3-4H,1-2H3;1-4H;3*1,3-4H2,2H3;.
What are the key properties of methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane?
methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane has a molecular weight of 1182.46 g/mol, XLogP of 12.54, 18 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-chloro-5-methylpyridine-2-carboxylate;methyl 5-methyl-4-pyridin-2-ylpyridine-2-carboxylate;5-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-4-pyridin-2-ylpyridine-2-carboxamide;tributyl(pyridin-2-yl)stannane is sourced from PubChem (CID 158733748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).