3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine

C18H14N4 — CID 45484973

IUPAC3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine
SMILESCc1c(-c2ccc3ccccc3c2)nnn1-c1cccnc1
InChIInChI=1S/C18H14N4/c1-13-18(20-21-22(13)17-7-4-10-19-12-17)16-9-8-14-5-2-3-6-15(14)11-16/h2-12H,1H3
InChIKeyCDMACXOEZRVPAK-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.79
Rot. Bonds2

About 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine

3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine (PubChem CID 45484973) has the molecular formula C18H14N4 and a molecular weight of 286.34 g/mol. Its IUPAC name is 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine.

Molecular Properties

Compound Name3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine
PubChem CID45484973
Molecular FormulaC18H14N4
Molecular Weight286.34 g/mol
Exact Mass286.12
IUPAC Name3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine
SMILESCc1c(-c2ccc3ccccc3c2)nnn1-c1cccnc1
InChIInChI=1S/C18H14N4/c1-13-18(20-21-22(13)17-7-4-10-19-12-17)16-9-8-14-5-2-3-6-15(14)11-16/h2-12H,1H3
InChIKeyCDMACXOEZRVPAK-UHFFFAOYSA-N
XLogP3.79
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]-4-(1-naphthylmethyl)-1-piperazinamine
CID 6886669
1H-Indole, 3-((4-methyl-1-naphthalenyl)methyl)-1-pentyl-
CID 85879908
Dibenzo(f,h)quinoxaline
CID 252644
6-[1-(2-Fluoropyridin-3-yl)-5-methyltriazol-4-yl]quinoline
CID 11301185
3-[4-[[4-(3-Chlorophenyl)triazol-1-yl]methyl]phenyl]pyridine
CID 155518832
2-(3,4-Dimethylphenyl)quinoxaline
CID 616375
3-[4-[[4-(4-Methylphenyl)triazol-1-yl]methyl]phenyl]pyridine
CID 155542000
3-[4-[[4-(3-Methylphenyl)triazol-1-yl]methyl]phenyl]pyridine
CID 155564309
1-[[6-(2-Fluorophenyl)-3-pyridinyl]methyl]benzotriazole
CID 155522079
2-(2-Naphthyl)indolizine
CID 1358093
2-[2-(2''''-Ethyl-biphenyl-3-yl)-2H-tetrazol-5-yl]-pyridine
CID 44395431
2-[2-[3-(2,6-Dimethylphenyl)phenyl]tetrazol-5-yl]pyridine
CID 44395493

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine?
The IUPAC name of 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine (CID 45484973) is 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine.
What is the SMILES notation for 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine?
The canonical SMILES for 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine is Cc1c(-c2ccc3ccccc3c2)nnn1-c1cccnc1.
What is the InChIKey of 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine?
The InChIKey is CDMACXOEZRVPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4/c1-13-18(20-21-22(13)17-7-4-10-19-12-17)16-9-8-14-5-2-3-6-15(14)11-16/h2-12H,1H3.
What are the key properties of 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine?
3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine has a molecular weight of 286.34 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-4-naphthalen-2-yltriazol-1-yl)pyridine is sourced from PubChem (CID 45484973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).