N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine

C15H20N4O — CID 155546135

IUPACN-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine
SMILESc1cnc2c(NCCCN3CCOCC3)ccnc2c1
InChIInChI=1S/C15H20N4O/c1-3-13-15(18-5-1)14(4-7-17-13)16-6-2-8-19-9-11-20-12-10-19/h1,3-5,7H,2,6,8-12H2,(H,16,17)
InChIKeyOJEPDNBJZDZLSM-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.76
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine

N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine (PubChem CID 155546135) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine
PubChem CID155546135
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine
SMILESc1cnc2c(NCCCN3CCOCC3)ccnc2c1
InChIInChI=1S/C15H20N4O/c1-3-13-15(18-5-1)14(4-7-17-13)16-6-2-8-19-9-11-20-12-10-19/h1,3-5,7H,2,6,8-12H2,(H,16,17)
InChIKeyOJEPDNBJZDZLSM-UHFFFAOYSA-N
XLogP1.76
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine (CID 155546135) is N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine is c1cnc2c(NCCCN3CCOCC3)ccnc2c1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine?
The InChIKey is OJEPDNBJZDZLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-3-13-15(18-5-1)14(4-7-17-13)16-6-2-8-19-9-11-20-12-10-19/h1,3-5,7H,2,6,8-12H2,(H,16,17).
What are the key properties of N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine?
N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine has a molecular weight of 272.35 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-1,5-naphthyridin-4-amine is sourced from PubChem (CID 155546135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).