N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide

C23H28N4O2 — CID 71536487

IUPACN-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide
SMILESCCC(=O)NCCN1CCCc2c(-c3ccc4c(c3)CCC(=O)N4C)cncc21
InChIInChI=1S/C23H28N4O2/c1-3-22(28)25-10-12-27-11-4-5-18-19(14-24-15-21(18)27)16-6-8-20-17(13-16)7-9-23(29)26(20)2/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,25,28)
InChIKeyYBWKRNZJXVKUQC-UHFFFAOYSA-N
MW392.50 g/mol
LogP2.94
Rot. Bonds5

About N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide

N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide (PubChem CID 71536487) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide
PubChem CID71536487
Molecular FormulaC23H28N4O2
Molecular Weight392.50 g/mol
Exact Mass392.22
IUPAC NameN-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide
SMILESCCC(=O)NCCN1CCCc2c(-c3ccc4c(c3)CCC(=O)N4C)cncc21
InChIInChI=1S/C23H28N4O2/c1-3-22(28)25-10-12-27-11-4-5-18-19(14-24-15-21(18)27)16-6-8-20-17(13-16)7-9-23(29)26(20)2/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,25,28)
InChIKeyYBWKRNZJXVKUQC-UHFFFAOYSA-N
XLogP2.94
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide?
The IUPAC name of N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide (CID 71536487) is N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide.
What is the SMILES notation for N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide?
The canonical SMILES for N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide is CCC(=O)NCCN1CCCc2c(-c3ccc4c(c3)CCC(=O)N4C)cncc21.
What is the InChIKey of N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide?
The InChIKey is YBWKRNZJXVKUQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c1-3-22(28)25-10-12-27-11-4-5-18-19(14-24-15-21(18)27)16-6-8-20-17(13-16)7-9-23(29)26(20)2/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,25,28).
What are the key properties of N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide?
N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide has a molecular weight of 392.50 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3,4-dihydro-2H-1,7-naphthyridin-1-yl]ethyl]propanamide is sourced from PubChem (CID 71536487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).