N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide

C18H17FN4O2 — CID 22346362

IUPACN-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide
SMILESCNc1nc(C(=O)NCc2ccc(F)cc2)c(OC)c2ncccc12
InChIInChI=1S/C18H17FN4O2/c1-20-17-13-4-3-9-21-14(13)16(25-2)15(23-17)18(24)22-10-11-5-7-12(19)8-6-11/h3-9H,10H2,1-2H3,(H,20,23)(H,22,24)
InChIKeyYZAKCXIWYHLUTA-UHFFFAOYSA-N
MW340.36 g/mol
LogP2.75
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide

N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide (PubChem CID 22346362) has the molecular formula C18H17FN4O2 and a molecular weight of 340.36 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide
PubChem CID22346362
Molecular FormulaC18H17FN4O2
Molecular Weight340.36 g/mol
Exact Mass340.13
IUPAC NameN-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide
SMILESCNc1nc(C(=O)NCc2ccc(F)cc2)c(OC)c2ncccc12
InChIInChI=1S/C18H17FN4O2/c1-20-17-13-4-3-9-21-14(13)16(25-2)15(23-17)18(24)22-10-11-5-7-12(19)8-6-11/h3-9H,10H2,1-2H3,(H,20,23)(H,22,24)
InChIKeyYZAKCXIWYHLUTA-UHFFFAOYSA-N
XLogP2.75
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide (CID 22346362) is N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide is CNc1nc(C(=O)NCc2ccc(F)cc2)c(OC)c2ncccc12.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide?
The InChIKey is YZAKCXIWYHLUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O2/c1-20-17-13-4-3-9-21-14(13)16(25-2)15(23-17)18(24)22-10-11-5-7-12(19)8-6-11/h3-9H,10H2,1-2H3,(H,20,23)(H,22,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide?
N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide has a molecular weight of 340.36 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-8-methoxy-5-(methylamino)-1,6-naphthyridine-7-carboxamide is sourced from PubChem (CID 22346362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).