N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide

C71H56N12O10S — CID 158590074

IUPACN-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide
SMILESNC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccccc4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccco4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4cccs4)nc3)c2)c1
InChIInChI=1S/C25H20N4O3.C23H18N4O4.C23H18N4O3S/c26-24(30)20-12-22(15-27-13-20)32-16-17-5-4-8-21(11-17)29-25(31)19-9-10-23(28-14-19)18-6-2-1-3-7-18;24-22(28)17-10-19(13-25-11-17)31-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-30-21;24-22(28)17-10-19(13-25-11-17)30-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-31-21/h1-15H,16H2,(H2,26,30)(H,29,31);2*1-13H,14H2,(H2,24,28)(H,27,29)
InChIKeyHUIIXORWPAMELO-UHFFFAOYSA-N
MW1269.37 g/mol
LogP11.88
Rot. Bonds21

About N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide

N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide (PubChem CID 158590074) has the molecular formula C71H56N12O10S and a molecular weight of 1269.37 g/mol. Its IUPAC name is N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide
PubChem CID158590074
Molecular FormulaC71H56N12O10S
Molecular Weight1269.37 g/mol
Exact Mass1268.40
IUPAC NameN-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide
SMILESNC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccccc4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccco4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4cccs4)nc3)c2)c1
InChIInChI=1S/C25H20N4O3.C23H18N4O4.C23H18N4O3S/c26-24(30)20-12-22(15-27-13-20)32-16-17-5-4-8-21(11-17)29-25(31)19-9-10-23(28-14-19)18-6-2-1-3-7-18;24-22(28)17-10-19(13-25-11-17)31-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-30-21;24-22(28)17-10-19(13-25-11-17)30-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-31-21/h1-15H,16H2,(H2,26,30)(H,29,31);2*1-13H,14H2,(H2,24,28)(H,27,29)
InChIKeyHUIIXORWPAMELO-UHFFFAOYSA-N
XLogP11.88
TPSA334.74 Ų
H-Bond Donors6
H-Bond Acceptors17
Rotatable Bonds21
Heavy Atoms94
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001269.37
LogP ≤ 511.88
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1017

Analyze N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide with MolForge

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Related Compounds

N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide
CID 124155906
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 124156389
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]-2,4-difluorophenyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 124155885
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]-4-fluorophenyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 124156726
4-[5-[5-[(1-adamantylamino)methyl]-2-pyridinyl]furan-2-yl]-N-[(6-thiophen-3-yl-3-pyridinyl)methyl]adamantan-1-amine
CID 123675596
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]-4-methylphenyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 124156545
4-[5-[5-[(1-adamantylamino)methyl]-2-pyridinyl]furan-3-yl]-N-[(6-thiophen-3-yl-3-pyridinyl)methyl]adamantan-1-amine
CID 134232448
2-Anilino-7-methyl-1-phenyl-5-(pyridin-3-yloxymethyl)-1,6-naphthyridin-4-one;2-anilino-1-phenyl-8-thiophen-2-yl-1,6-naphthyridin-4-one;ethane
CID 142225082
1-[2,3-bis(1H-pyrrol-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-(2,3-diphenylquinoxalin-6-yl)-3-(4-methylphenyl)propan-2-one;1-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3-(4-methylphenyl)propan-2-one;1-(2,3-dithiophen-2-ylquinoxalin-6-yl)-3-(4-methylphenyl)propan-2-one;1-[2-(furan-2-yl)-3-methylquinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[3-(furan-2-yl)-2-methylquinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one
CID 157953810
6-(3-aminophenyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(1-benzofuran-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(1-benzothiophen-3-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide
CID 157980457
(6S)-2-amino-3,6-dimethyl-5-morpholin-4-yl-6-[4-(5-propyl-3-pyridinyl)thiophen-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 158743690
4-[1'-(cyclobutylmethyl)-4-oxospiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-6-yl]-N-[(3-fluorophenyl)methyl]benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;6-[1'-(4-methoxybutyl)-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]-N-[(5-methyl-3-pyridinyl)methyl]pyridine-3-carboxamide;4-[1'-(3-methylbutyl)-4-oxospiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-6-yl]-N-[(5-methyl-3-pyridinyl)methyl]benzamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide
CID 158856755

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide?
The IUPAC name of N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide (CID 158590074) is N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide is NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccccc4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4ccco4)nc3)c2)c1.NC(=O)c1cncc(OCc2cccc(NC(=O)c3ccc(-c4cccs4)nc3)c2)c1.
What is the InChIKey of N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide?
The InChIKey is HUIIXORWPAMELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4O3.C23H18N4O4.C23H18N4O3S/c26-24(30)20-12-22(15-27-13-20)32-16-17-5-4-8-21(11-17)29-25(31)19-9-10-23(28-14-19)18-6-2-1-3-7-18;24-22(28)17-10-19(13-25-11-17)31-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-30-21;24-22(28)17-10-19(13-25-11-17)30-14-15-3-1-4-18(9-15)27-23(29)16-6-7-20(26-12-16)21-5-2-8-31-21/h1-15H,16H2,(H2,26,30)(H,29,31);2*1-13H,14H2,(H2,24,28)(H,27,29).
What are the key properties of N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide?
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide has a molecular weight of 1269.37 g/mol, XLogP of 11.88, 21 rotatable bonds, 6 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-(furan-2-yl)pyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide;N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 158590074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).