4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline

C27H25NO — CID 166570041

IUPAC4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline
SMILESCc1oc2c(c(-c3cc(C(C)(C)C)c4ccccc4c3)nc3ccccc32)c1C
InChIInChI=1S/C27H25NO/c1-16-17(2)29-26-21-12-8-9-13-23(21)28-25(24(16)26)19-14-18-10-6-7-11-20(18)22(15-19)27(3,4)5/h6-15H,1-5H3
InChIKeyUGDRCSFBBCVQCG-UHFFFAOYSA-N
MW379.50 g/mol
LogP7.72
Rot. Bonds1

About 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline

4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline (PubChem CID 166570041) has the molecular formula C27H25NO and a molecular weight of 379.50 g/mol. Its IUPAC name is 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline.

Molecular Properties

Compound Name4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline
PubChem CID166570041
Molecular FormulaC27H25NO
Molecular Weight379.50 g/mol
Exact Mass379.19
IUPAC Name4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline
SMILESCc1oc2c(c(-c3cc(C(C)(C)C)c4ccccc4c3)nc3ccccc32)c1C
InChIInChI=1S/C27H25NO/c1-16-17(2)29-26-21-12-8-9-13-23(21)28-25(24(16)26)19-14-18-10-6-7-11-20(18)22(15-19)27(3,4)5/h6-15H,1-5H3
InChIKeyUGDRCSFBBCVQCG-UHFFFAOYSA-N
XLogP7.72
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.50
LogP ≤ 57.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline 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

8-(4-tert-butylnaphthalen-2-yl)-4,11-dimethyl-3,12-dioxa-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),4,7,10-pentaene
CID 172520345
7-(4-tert-butylnaphthalen-2-yl)-2-iodo-3-methylfuro[2,3-c]pyridine
CID 170660648
6-(4-tert-butylnaphthalen-2-yl)-[1]benzothiolo[2,3-c]quinoline
CID 167354335
6-(4-tert-butylnaphthalen-2-yl)-1,3-dimethyl-10-propan-2-yl-[1]benzofuro[3,2-c]quinoline
CID 167354769
2-(4-tert-butylnaphthalen-2-yl)-4,5-dimethylquinoline
CID 134387972
1-(4-tert-butylnaphthalen-2-yl)-4-methyl-5-(trifluoromethyl)benzo[g]phthalazine
CID 155760281
[7-(4-tert-butylnaphthalen-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-methyl-diphenylsilane
CID 170566810
[4-[7-(4-tert-butylnaphthalen-2-yl)-3-methylfuro[2,3-c]pyridin-2-yl]phenyl]-trimethylgermane
CID 168743416
6-(4-tert-butylnaphthalen-2-yl)-8-propan-2-yl-[1]benzothiolo[3,2-c]quinoline
CID 167354676
6-(4-tert-butylnaphthalen-2-yl)-11,11-dimethyl-[1]benzosilolo[3,2-c]quinoline
CID 167354672
12-(4-tert-butylnaphthalen-2-yl)-14-methyl-5-propan-2-yl-17-oxa-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11,13,15-octaene
CID 168815916
[7-(4-tert-butylnaphthalen-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-triphenylsilane
CID 170566811

Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline?
The IUPAC name of 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline (CID 166570041) is 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline.
What is the SMILES notation for 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline?
The canonical SMILES for 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline is Cc1oc2c(c(-c3cc(C(C)(C)C)c4ccccc4c3)nc3ccccc32)c1C.
What is the InChIKey of 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline?
The InChIKey is UGDRCSFBBCVQCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25NO/c1-16-17(2)29-26-21-12-8-9-13-23(21)28-25(24(16)26)19-14-18-10-6-7-11-20(18)22(15-19)27(3,4)5/h6-15H,1-5H3.
What are the key properties of 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline?
4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline has a molecular weight of 379.50 g/mol, XLogP of 7.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylnaphthalen-2-yl)-2,3-dimethylfuro[3,2-c]quinoline is sourced from PubChem (CID 166570041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).