6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine

C23H28N2O — CID 18386670

IUPAC6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine
SMILESCCC(CC)c1ccnc2c(Oc3c(C)cc(C)cc3C)nc(C)cc12
InChIInChI=1S/C23H28N2O/c1-7-18(8-2)19-9-10-24-21-20(19)13-17(6)25-23(21)26-22-15(4)11-14(3)12-16(22)5/h9-13,18H,7-8H2,1-6H3
InChIKeyADHQXRHZVHPBID-UHFFFAOYSA-N
MW348.49 g/mol
LogP6.56
Rot. Bonds5

About 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine

6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine (PubChem CID 18386670) has the molecular formula C23H28N2O and a molecular weight of 348.49 g/mol. Its IUPAC name is 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine.

Molecular Properties

Compound Name6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine
PubChem CID18386670
Molecular FormulaC23H28N2O
Molecular Weight348.49 g/mol
Exact Mass348.22
IUPAC Name6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine
SMILESCCC(CC)c1ccnc2c(Oc3c(C)cc(C)cc3C)nc(C)cc12
InChIInChI=1S/C23H28N2O/c1-7-18(8-2)19-9-10-24-21-20(19)13-17(6)25-23(21)26-22-15(4)11-14(3)12-16(22)5/h9-13,18H,7-8H2,1-6H3
InChIKeyADHQXRHZVHPBID-UHFFFAOYSA-N
XLogP6.56
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine with MolForge

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Related Compounds

4-(3-deuteriopentan-3-yl)-3,6-dimethyl-2-(2,4,6-trimethylphenoxy)pyridine
CID 56980443
3-methyl-5-pentan-3-yl-N-(2,4,6-trimethylphenyl)-2,6-naphthyridin-1-amine
CID 18386611
6-methyl-5-pentan-3-yl-2-(2,4,6-trimethylphenoxy)pyridine-3,4-diamine
CID 86759589
7-methyl-1-pentan-3-yl-5-(2,4,6-trimethylphenoxy)-3,4-dihydropyrido[4,3-d]pyrimidin-2-one
CID 18386643
3-[2-(4-chloro-2,6-dimethylphenoxy)-3,6-dimethyl-4-pyridinyl]pentan-1-amine
CID 56993004
2-(2,4,6-trimethylphenoxy)pyridine-3,4-diamine
CID 67697104
2-ethyl-4-(2,4,6-trimethylphenoxy)pyridine
CID 142846959
3,6-dimethyl-1-pentan-3-yl-4-(2,4,6-trimethylphenoxy)-3H-pyrrolo[3,2-c]pyridin-2-one
CID 22253373
ethyl 6-methyl-4-(pentan-3-ylamino)-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylate
CID 154682760
4-(2,6-dimethyl-4-propylphenoxy)-3,6-dimethyl-1-pentan-3-ylpyrrolo[3,2-c]pyridine
CID 22253378
N-(1-azidobutan-2-yl)-3,6-dimethyl-2-(2,4,6-trimethylphenoxy)pyridin-4-amine
CID 22603175
4-(1-ethoxypropoxy)-2,5-dimethyl-6-(2,4,6-trimethylphenoxy)pyrimidine
CID 23216567

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine?
The IUPAC name of 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine (CID 18386670) is 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine.
What is the SMILES notation for 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine?
The canonical SMILES for 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine is CCC(CC)c1ccnc2c(Oc3c(C)cc(C)cc3C)nc(C)cc12.
What is the InChIKey of 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine?
The InChIKey is ADHQXRHZVHPBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O/c1-7-18(8-2)19-9-10-24-21-20(19)13-17(6)25-23(21)26-22-15(4)11-14(3)12-16(22)5/h9-13,18H,7-8H2,1-6H3.
What are the key properties of 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine?
6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine has a molecular weight of 348.49 g/mol, XLogP of 6.56, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-pentan-3-yl-8-(2,4,6-trimethylphenoxy)-1,7-naphthyridine is sourced from PubChem (CID 18386670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).