N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide

C17H17N5O2 — CID 138589552

IUPACN-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
SMILESO=C(Nc1cc2cc(-c3cnco3)cnc2cn1)C1CCNCC1
InChIInChI=1S/C17H17N5O2/c23-17(11-1-3-18-4-2-11)22-16-6-12-5-13(15-9-19-10-24-15)7-20-14(12)8-21-16/h5-11,18H,1-4H2,(H,21,22,23)
InChIKeyDTIGVCJSBWHRAE-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.22
Rot. Bonds3

About N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide

N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide (PubChem CID 138589552) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
PubChem CID138589552
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC NameN-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
SMILESO=C(Nc1cc2cc(-c3cnco3)cnc2cn1)C1CCNCC1
InChIInChI=1S/C17H17N5O2/c23-17(11-1-3-18-4-2-11)22-16-6-12-5-13(15-9-19-10-24-15)7-20-14(12)8-21-16/h5-11,18H,1-4H2,(H,21,22,23)
InChIKeyDTIGVCJSBWHRAE-UHFFFAOYSA-N
XLogP2.22
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide?
The IUPAC name of N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide (CID 138589552) is N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide.
What is the SMILES notation for N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide?
The canonical SMILES for N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide is O=C(Nc1cc2cc(-c3cnco3)cnc2cn1)C1CCNCC1.
What is the InChIKey of N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide?
The InChIKey is DTIGVCJSBWHRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c23-17(11-1-3-18-4-2-11)22-16-6-12-5-13(15-9-19-10-24-15)7-20-14(12)8-21-16/h5-11,18H,1-4H2,(H,21,22,23).
What are the key properties of N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide?
N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide is sourced from PubChem (CID 138589552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).