(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide

C21H19N3O2 — CID 90466675

IUPAC(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H19N3O2/c22-19(10-14-4-2-1-3-5-14)21(25)24-16-6-7-18-17-8-9-23-12-15(17)13-26-20(18)11-16/h1-9,11-12,19H,10,13,22H2,(H,24,25)/t19-/m1/s1
InChIKeyRNAFKLYSCSXHPD-LJQANCHMSA-N
MW345.40 g/mol
LogP3.15
Rot. Bonds4

About (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide

(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide (PubChem CID 90466675) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide
PubChem CID90466675
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H19N3O2/c22-19(10-14-4-2-1-3-5-14)21(25)24-16-6-7-18-17-8-9-23-12-15(17)13-26-20(18)11-16/h1-9,11-12,19H,10,13,22H2,(H,24,25)/t19-/m1/s1
InChIKeyRNAFKLYSCSXHPD-LJQANCHMSA-N
XLogP3.15
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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N-[(1R)-1-(3-methoxyphenyl)ethyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide (CID 90466675) is (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide is N[C@H](Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide?
The InChIKey is RNAFKLYSCSXHPD-LJQANCHMSA-N. The full InChI is InChI=1S/C21H19N3O2/c22-19(10-14-4-2-1-3-5-14)21(25)24-16-6-7-18-17-8-9-23-12-15(17)13-26-20(18)11-16/h1-9,11-12,19H,10,13,22H2,(H,24,25)/t19-/m1/s1.
What are the key properties of (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide?
(2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide has a molecular weight of 345.40 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(5H-chromeno[3,4-c]pyridin-8-yl)-3-phenylpropanamide is sourced from PubChem (CID 90466675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).