N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide

C19H17ClN2O4 — CID 1223030

IUPACN-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide
SMILESCCOc1ccc(OCc2ccc(C(=O)Nc3ccc(Cl)cn3)o2)cc1
InChIInChI=1S/C19H17ClN2O4/c1-2-24-14-4-6-15(7-5-14)25-12-16-8-9-17(26-16)19(23)22-18-10-3-13(20)11-21-18/h3-11H,2,12H2,1H3,(H,21,22,23)
InChIKeyVXPNLKWYIGPBGT-UHFFFAOYSA-N
MW372.81 g/mol
LogP4.56
Rot. Bonds7

About N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide

N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide (PubChem CID 1223030) has the molecular formula C19H17ClN2O4 and a molecular weight of 372.81 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide
PubChem CID1223030
Molecular FormulaC19H17ClN2O4
Molecular Weight372.81 g/mol
Exact Mass372.09
IUPAC NameN-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide
SMILESCCOc1ccc(OCc2ccc(C(=O)Nc3ccc(Cl)cn3)o2)cc1
InChIInChI=1S/C19H17ClN2O4/c1-2-24-14-4-6-15(7-5-14)25-12-16-8-9-17(26-16)19(23)22-18-10-3-13(20)11-21-18/h3-11H,2,12H2,1H3,(H,21,22,23)
InChIKeyVXPNLKWYIGPBGT-UHFFFAOYSA-N
XLogP4.56
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide (CID 1223030) is N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide is CCOc1ccc(OCc2ccc(C(=O)Nc3ccc(Cl)cn3)o2)cc1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide?
The InChIKey is VXPNLKWYIGPBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O4/c1-2-24-14-4-6-15(7-5-14)25-12-16-8-9-17(26-16)19(23)22-18-10-3-13(20)11-21-18/h3-11H,2,12H2,1H3,(H,21,22,23).
What are the key properties of N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide?
N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide has a molecular weight of 372.81 g/mol, XLogP of 4.56, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 1223030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).