3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide

C21H17ClN2O2 — CID 90466830

IUPAC3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide
SMILESO=C(CCc1ccc(Cl)cc1)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H17ClN2O2/c22-16-4-1-14(2-5-16)3-8-21(25)24-17-6-7-19-18-9-10-23-12-15(18)13-26-20(19)11-17/h1-2,4-7,9-12H,3,8,13H2,(H,24,25)
InChIKeyBAXHOUDRVWMQHU-UHFFFAOYSA-N
MW364.83 g/mol
LogP4.87
Rot. Bonds4

About 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide

3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide (PubChem CID 90466830) has the molecular formula C21H17ClN2O2 and a molecular weight of 364.83 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide
PubChem CID90466830
Molecular FormulaC21H17ClN2O2
Molecular Weight364.83 g/mol
Exact Mass364.10
IUPAC Name3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide
SMILESO=C(CCc1ccc(Cl)cc1)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H17ClN2O2/c22-16-4-1-14(2-5-16)3-8-21(25)24-17-6-7-19-18-9-10-23-12-15(18)13-26-20(19)11-17/h1-2,4-7,9-12H,3,8,13H2,(H,24,25)
InChIKeyBAXHOUDRVWMQHU-UHFFFAOYSA-N
XLogP4.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.83
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide (CID 90466830) is 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide is O=C(CCc1ccc(Cl)cc1)Nc1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide?
The InChIKey is BAXHOUDRVWMQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O2/c22-16-4-1-14(2-5-16)3-8-21(25)24-17-6-7-19-18-9-10-23-12-15(18)13-26-20(19)11-17/h1-2,4-7,9-12H,3,8,13H2,(H,24,25).
What are the key properties of 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide?
3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide has a molecular weight of 364.83 g/mol, XLogP of 4.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-(5H-chromeno[3,4-c]pyridin-8-yl)propanamide is sourced from PubChem (CID 90466830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).