N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide

C19H18N2O5S — CID 9156708

IUPACN-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)[C@@H](CNC(=O)c2ccco2)c2cccnc2)cc1
InChIInChI=1S/C19H18N2O5S/c1-25-15-6-8-16(9-7-15)27(23,24)18(14-4-2-10-20-12-14)13-21-19(22)17-5-3-11-26-17/h2-12,18H,13H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyOSRBWUULPNEXLH-SFHVURJKSA-N
MW386.43 g/mol
LogP2.63
Rot. Bonds7

About N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide

N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide (PubChem CID 9156708) has the molecular formula C19H18N2O5S and a molecular weight of 386.43 g/mol. Its IUPAC name is N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide
PubChem CID9156708
Molecular FormulaC19H18N2O5S
Molecular Weight386.43 g/mol
Exact Mass386.09
IUPAC NameN-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)[C@@H](CNC(=O)c2ccco2)c2cccnc2)cc1
InChIInChI=1S/C19H18N2O5S/c1-25-15-6-8-16(9-7-15)27(23,24)18(14-4-2-10-20-12-14)13-21-19(22)17-5-3-11-26-17/h2-12,18H,13H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyOSRBWUULPNEXLH-SFHVURJKSA-N
XLogP2.63
TPSA98.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide?
The IUPAC name of N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide (CID 9156708) is N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide?
The canonical SMILES for N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide is COc1ccc(S(=O)(=O)[C@@H](CNC(=O)c2ccco2)c2cccnc2)cc1.
What is the InChIKey of N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide?
The InChIKey is OSRBWUULPNEXLH-SFHVURJKSA-N. The full InChI is InChI=1S/C19H18N2O5S/c1-25-15-6-8-16(9-7-15)27(23,24)18(14-4-2-10-20-12-14)13-21-19(22)17-5-3-11-26-17/h2-12,18H,13H2,1H3,(H,21,22)/t18-/m0/s1.
What are the key properties of N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide?
N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide has a molecular weight of 386.43 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]furan-2-carboxamide is sourced from PubChem (CID 9156708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).