2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide

C15H14N4O2 — CID 24710997

IUPAC2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc(Oc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C15H14N4O2/c16-15(17)10-5-6-18-14(8-10)21-11-2-3-12-9(7-11)1-4-13(20)19-12/h2-3,5-8H,1,4H2,(H3,16,17)(H,19,20)
InChIKeyRTTMWABRMKESLE-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.04
Rot. Bonds3

About 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide

2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide (PubChem CID 24710997) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide.

Molecular Properties

Compound Name2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide
PubChem CID24710997
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc(Oc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C15H14N4O2/c16-15(17)10-5-6-18-14(8-10)21-11-2-3-12-9(7-11)1-4-13(20)19-12/h2-3,5-8H,1,4H2,(H3,16,17)(H,19,20)
InChIKeyRTTMWABRMKESLE-UHFFFAOYSA-N
XLogP2.04
TPSA101.09 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide?
The IUPAC name of 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide (CID 24710997) is 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide.
What is the SMILES notation for 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide?
The canonical SMILES for 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide is [H]/N=C(\N)c1ccnc(Oc2ccc3c(c2)CCC(=O)N3)c1.
What is the InChIKey of 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide?
The InChIKey is RTTMWABRMKESLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c16-15(17)10-5-6-18-14(8-10)21-11-2-3-12-9(7-11)1-4-13(20)19-12/h2-3,5-8H,1,4H2,(H3,16,17)(H,19,20).
What are the key properties of 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide?
2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide has a molecular weight of 282.30 g/mol, XLogP of 2.04, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-4-carboximidamide is sourced from PubChem (CID 24710997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).