7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide

C21H17ClN2O2 — CID 92502311

IUPAC7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide
SMILESC[C@H](CNC(=O)c1cc2cc3ccc(Cl)cc3nc2o1)c1ccccc1
InChIInChI=1S/C21H17ClN2O2/c1-13(14-5-3-2-4-6-14)12-23-20(25)19-10-16-9-15-7-8-17(22)11-18(15)24-21(16)26-19/h2-11,13H,12H2,1H3,(H,23,25)/t13-/m1/s1
InChIKeyJUTDJTVFOOIZGZ-CYBMUJFWSA-N
MW364.83 g/mol
LogP5.17
Rot. Bonds4

About 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide

7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide (PubChem CID 92502311) has the molecular formula C21H17ClN2O2 and a molecular weight of 364.83 g/mol. Its IUPAC name is 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide
PubChem CID92502311
Molecular FormulaC21H17ClN2O2
Molecular Weight364.83 g/mol
Exact Mass364.10
IUPAC Name7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide
SMILESC[C@H](CNC(=O)c1cc2cc3ccc(Cl)cc3nc2o1)c1ccccc1
InChIInChI=1S/C21H17ClN2O2/c1-13(14-5-3-2-4-6-14)12-23-20(25)19-10-16-9-15-7-8-17(22)11-18(15)24-21(16)26-19/h2-11,13H,12H2,1H3,(H,23,25)/t13-/m1/s1
InChIKeyJUTDJTVFOOIZGZ-CYBMUJFWSA-N
XLogP5.17
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.83
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
CID 9427401
7-chloro-N-[(2-ethoxyphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
CID 22582863
N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
CID 9302248
7-chloro-N-cycloheptylfuro[2,3-b]quinoline-2-carboxamide
CID 3618281
2-(2,4-dichlorophenyl)-N-[(2S)-2-phenylpropyl]acetamide
CID 9302274
2-(2,5-dichlorophenyl)sulfanyl-N-[(2S)-2-phenylpropyl]acetamide
CID 7870470
N-[(2R)-2-phenylpropyl]pyridine-2-carboxamide
CID 9302014
6-chloro-2-methyl-N-[(2S)-2-phenylpropyl]quinoline-5-carboxamide
CID 11772124
4-chloro-N-[2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl]pyridine-2-carboxamide
CID 9427363
N-[2-(4-chlorophenyl)propyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 171470034
5-(3-chlorophenyl)-N-[(2R)-2-phenylpropyl]-1,3-oxazole-4-carboxamide
CID 92711313
3-bromo-5-chloro-N-(2-phenylpropyl)benzamide
CID 107951717

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide (CID 92502311) is 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide is C[C@H](CNC(=O)c1cc2cc3ccc(Cl)cc3nc2o1)c1ccccc1.
What is the InChIKey of 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide?
The InChIKey is JUTDJTVFOOIZGZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C21H17ClN2O2/c1-13(14-5-3-2-4-6-14)12-23-20(25)19-10-16-9-15-7-8-17(22)11-18(15)24-21(16)26-19/h2-11,13H,12H2,1H3,(H,23,25)/t13-/m1/s1.
What are the key properties of 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide?
7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide has a molecular weight of 364.83 g/mol, XLogP of 5.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-[(2S)-2-phenylpropyl]furo[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 92502311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).