N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide

C24H25FN6O4 — CID 10050824

IUPACN-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
SMILESCOc1ccc2ncc(F)c(CCN3CCC(NC(=O)c4ccc5c(n4)NC(=O)CO5)CC3)c2n1
InChIInChI=1S/C24H25FN6O4/c1-34-21-5-3-17-22(30-21)15(16(25)12-26-17)8-11-31-9-6-14(7-10-31)27-24(33)18-2-4-19-23(28-18)29-20(32)13-35-19/h2-5,12,14H,6-11,13H2,1H3,(H,27,33)(H,28,29,32)
InChIKeyVOEIGAONVCKZED-UHFFFAOYSA-N
MW480.50 g/mol
LogP1.94
Rot. Bonds6

About N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide

N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide (PubChem CID 10050824) has the molecular formula C24H25FN6O4 and a molecular weight of 480.50 g/mol. Its IUPAC name is N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
PubChem CID10050824
Molecular FormulaC24H25FN6O4
Molecular Weight480.50 g/mol
Exact Mass480.19
IUPAC NameN-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
SMILESCOc1ccc2ncc(F)c(CCN3CCC(NC(=O)c4ccc5c(n4)NC(=O)CO5)CC3)c2n1
InChIInChI=1S/C24H25FN6O4/c1-34-21-5-3-17-22(30-21)15(16(25)12-26-17)8-11-31-9-6-14(7-10-31)27-24(33)18-2-4-19-23(28-18)29-20(32)13-35-19/h2-5,12,14H,6-11,13H2,1H3,(H,27,33)(H,28,29,32)
InChIKeyVOEIGAONVCKZED-UHFFFAOYSA-N
XLogP1.94
TPSA118.57 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.50
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The IUPAC name of N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide (CID 10050824) is N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide.
What is the SMILES notation for N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The canonical SMILES for N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide is COc1ccc2ncc(F)c(CCN3CCC(NC(=O)c4ccc5c(n4)NC(=O)CO5)CC3)c2n1.
What is the InChIKey of N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The InChIKey is VOEIGAONVCKZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN6O4/c1-34-21-5-3-17-22(30-21)15(16(25)12-26-17)8-11-31-9-6-14(7-10-31)27-24(33)18-2-4-19-23(28-18)29-20(32)13-35-19/h2-5,12,14H,6-11,13H2,1H3,(H,27,33)(H,28,29,32).
What are the key properties of N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide has a molecular weight of 480.50 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide is sourced from PubChem (CID 10050824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).