N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

C64H54F3N11O12S3 — CID 90013240

IUPACN-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOCc1cccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)cc2)c1.COc1cncc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c1.Cn1cc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c(C(F)(F)F)n1
InChIInChI=1S/C23H20N2O5S.C21H18N4O4S.C20H16F3N5O3S/c1-29-15-17-3-2-4-20(11-17)31(27,28)19-7-5-16(6-8-19)13-25-23(26)21-12-18-9-10-24-14-22(18)30-21;1-29-17-10-19(13-22-12-17)30(27,28)18-5-2-15(3-6-18)11-24-21(26)16-4-7-20-23-8-9-25(20)14-16;1-27-12-16(18(26-27)20(21,22)23)32(30,31)15-5-2-13(3-6-15)10-25-19(29)14-4-7-17-24-8-9-28(17)11-14/h2-12,14H,13,15H2,1H3,(H,25,26);2-10,12-14H,11H2,1H3,(H,24,26);2-9,11-12H,10H2,1H3,(H,25,29)
InChIKeyHUBLOHYATOGVMP-UHFFFAOYSA-N
MW1322.40 g/mol
LogP9.09
Rot. Bonds18

About N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 90013240) has the molecular formula C64H54F3N11O12S3 and a molecular weight of 1322.40 g/mol. Its IUPAC name is N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID90013240
Molecular FormulaC64H54F3N11O12S3
Molecular Weight1322.40 g/mol
Exact Mass1321.31
IUPAC NameN-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOCc1cccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)cc2)c1.COc1cncc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c1.Cn1cc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c(C(F)(F)F)n1
InChIInChI=1S/C23H20N2O5S.C21H18N4O4S.C20H16F3N5O3S/c1-29-15-17-3-2-4-20(11-17)31(27,28)19-7-5-16(6-8-19)13-25-23(26)21-12-18-9-10-24-14-22(18)30-21;1-29-17-10-19(13-22-12-17)30(27,28)18-5-2-15(3-6-18)11-24-21(26)16-4-7-20-23-8-9-25(20)14-16;1-27-12-16(18(26-27)20(21,22)23)32(30,31)15-5-2-13(3-6-15)10-25-19(29)14-4-7-17-24-8-9-28(17)11-14/h2-12,14H,13,15H2,1H3,(H,25,26);2-10,12-14H,11H2,1H3,(H,24,26);2-9,11-12H,10H2,1H3,(H,25,29)
InChIKeyHUBLOHYATOGVMP-UHFFFAOYSA-N
XLogP9.09
TPSA299.52 Ų
H-Bond Donors3
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms93
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001322.40
LogP ≤ 59.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1020

Analyze N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 90013240) is N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is COCc1cccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)cc2)c1.COc1cncc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c1.Cn1cc(S(=O)(=O)c2ccc(CNC(=O)c3ccc4nccn4c3)cc2)c(C(F)(F)F)n1.
What is the InChIKey of N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is HUBLOHYATOGVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O5S.C21H18N4O4S.C20H16F3N5O3S/c1-29-15-17-3-2-4-20(11-17)31(27,28)19-7-5-16(6-8-19)13-25-23(26)21-12-18-9-10-24-14-22(18)30-21;1-29-17-10-19(13-22-12-17)30(27,28)18-5-2-15(3-6-18)11-24-21(26)16-4-7-20-23-8-9-25(20)14-16;1-27-12-16(18(26-27)20(21,22)23)32(30,31)15-5-2-13(3-6-15)10-25-19(29)14-4-7-17-24-8-9-28(17)11-14/h2-12,14H,13,15H2,1H3,(H,25,26);2-10,12-14H,11H2,1H3,(H,24,26);2-9,11-12H,10H2,1H3,(H,25,29).
What are the key properties of N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 1322.40 g/mol, XLogP of 9.09, 18 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[3-(methoxymethyl)phenyl]sulfonylphenyl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[4-[(5-methoxy-3-pyridinyl)sulfonyl]phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 90013240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).