8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine

C19H18F2N2O2 — CID 155757550

IUPAC8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine
SMILESCCCc1ccc2cnc(OC)c(-c3ccc(OC(F)F)cc3)c2n1
InChIInChI=1S/C19H18F2N2O2/c1-3-4-14-8-5-13-11-22-18(24-2)16(17(13)23-14)12-6-9-15(10-7-12)25-19(20)21/h5-11,19H,3-4H2,1-2H3
InChIKeyLBNSMGLCWNWNLW-UHFFFAOYSA-N
MW344.36 g/mol
LogP4.86
Rot. Bonds6

About 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine

8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine (PubChem CID 155757550) has the molecular formula C19H18F2N2O2 and a molecular weight of 344.36 g/mol. Its IUPAC name is 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine.

Molecular Properties

Compound Name8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine
PubChem CID155757550
Molecular FormulaC19H18F2N2O2
Molecular Weight344.36 g/mol
Exact Mass344.13
IUPAC Name8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine
SMILESCCCc1ccc2cnc(OC)c(-c3ccc(OC(F)F)cc3)c2n1
InChIInChI=1S/C19H18F2N2O2/c1-3-4-14-8-5-13-11-22-18(24-2)16(17(13)23-14)12-6-9-15(10-7-12)25-19(20)21/h5-11,19H,3-4H2,1-2H3
InChIKeyLBNSMGLCWNWNLW-UHFFFAOYSA-N
XLogP4.86
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.36
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine?
The IUPAC name of 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine (CID 155757550) is 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine.
What is the SMILES notation for 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine?
The canonical SMILES for 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine is CCCc1ccc2cnc(OC)c(-c3ccc(OC(F)F)cc3)c2n1.
What is the InChIKey of 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine?
The InChIKey is LBNSMGLCWNWNLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2O2/c1-3-4-14-8-5-13-11-22-18(24-2)16(17(13)23-14)12-6-9-15(10-7-12)25-19(20)21/h5-11,19H,3-4H2,1-2H3.
What are the key properties of 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine?
8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine has a molecular weight of 344.36 g/mol, XLogP of 4.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[4-(difluoromethoxy)phenyl]-7-methoxy-2-propyl-1,6-naphthyridine is sourced from PubChem (CID 155757550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).