3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide

C22H17N3O2 — CID 150166666

IUPAC3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide
SMILESCc1cc2ncccc2nc1C(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C22H17N3O2/c1-15-13-20-19(11-6-12-23-20)25-21(15)22(26)24-16-7-5-10-18(14-16)27-17-8-3-2-4-9-17/h2-14H,1H3,(H,24,26)
InChIKeyFINUQEICJQRBQH-UHFFFAOYSA-N
MW355.40 g/mol
LogP4.98
Rot. Bonds4

About 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide

3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide (PubChem CID 150166666) has the molecular formula C22H17N3O2 and a molecular weight of 355.40 g/mol. Its IUPAC name is 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide
PubChem CID150166666
Molecular FormulaC22H17N3O2
Molecular Weight355.40 g/mol
Exact Mass355.13
IUPAC Name3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide
SMILESCc1cc2ncccc2nc1C(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C22H17N3O2/c1-15-13-20-19(11-6-12-23-20)25-21(15)22(26)24-16-7-5-10-18(14-16)27-17-8-3-2-4-9-17/h2-14H,1H3,(H,24,26)
InChIKeyFINUQEICJQRBQH-UHFFFAOYSA-N
XLogP4.98
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide (CID 150166666) is 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide is Cc1cc2ncccc2nc1C(=O)Nc1cccc(Oc2ccccc2)c1.
What is the InChIKey of 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide?
The InChIKey is FINUQEICJQRBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2/c1-15-13-20-19(11-6-12-23-20)25-21(15)22(26)24-16-7-5-10-18(14-16)27-17-8-3-2-4-9-17/h2-14H,1H3,(H,24,26).
What are the key properties of 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide?
3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide has a molecular weight of 355.40 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-phenoxyphenyl)-1,5-naphthyridine-2-carboxamide is sourced from PubChem (CID 150166666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).