6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C18H20N4O3 — CID 86305370

IUPAC6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(C4(O)CCOC4)c3)cnc21
InChIInChI=1S/C18H20N4O3/c19-17(23)22-4-1-2-12-6-13(9-21-16(12)22)14-7-15(10-20-8-14)18(24)3-5-25-11-18/h6-10,24H,1-5,11H2,(H2,19,23)
InChIKeyJBLOUOQPNSNMCD-UHFFFAOYSA-N
MW340.38 g/mol
LogP1.58
Rot. Bonds2

About 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305370) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305370
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(C4(O)CCOC4)c3)cnc21
InChIInChI=1S/C18H20N4O3/c19-17(23)22-4-1-2-12-6-13(9-21-16(12)22)14-7-15(10-20-8-14)18(24)3-5-25-11-18/h6-10,24H,1-5,11H2,(H2,19,23)
InChIKeyJBLOUOQPNSNMCD-UHFFFAOYSA-N
XLogP1.58
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305370) is 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1CCCc2cc(-c3cncc(C4(O)CCOC4)c3)cnc21.
What is the InChIKey of 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is JBLOUOQPNSNMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3/c19-17(23)22-4-1-2-12-6-13(9-21-16(12)22)14-7-15(10-20-8-14)18(24)3-5-25-11-18/h6-10,24H,1-5,11H2,(H2,19,23).
What are the key properties of 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).