11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole

C32H28N2O2 — CID 14634648

IUPAC11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole
SMILESCOc1cc(Cn2c3ccccc3c3cc(C)c4c(c32)C=CC(C)(C)O4)cc2c1[nH]c1ccccc12
InChIInChI=1S/C32H28N2O2/c1-19-15-25-22-10-6-8-12-27(22)34(30(25)23-13-14-32(2,3)36-31(19)23)18-20-16-24-21-9-5-7-11-26(21)33-29(24)28(17-20)35-4/h5-17,33H,18H2,1-4H3
InChIKeyJUGKQFUWRSKZKH-UHFFFAOYSA-N
MW472.59 g/mol
LogP7.98
Rot. Bonds3

About 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole

11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole (PubChem CID 14634648) has the molecular formula C32H28N2O2 and a molecular weight of 472.59 g/mol. Its IUPAC name is 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole.

Molecular Properties

Compound Name11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole
PubChem CID14634648
Molecular FormulaC32H28N2O2
Molecular Weight472.59 g/mol
Exact Mass472.22
IUPAC Name11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole
SMILESCOc1cc(Cn2c3ccccc3c3cc(C)c4c(c32)C=CC(C)(C)O4)cc2c1[nH]c1ccccc12
InChIInChI=1S/C32H28N2O2/c1-19-15-25-22-10-6-8-12-27(22)34(30(25)23-13-14-32(2,3)36-31(19)23)18-20-16-24-21-9-5-7-11-26(21)33-29(24)28(17-20)35-4/h5-17,33H,18H2,1-4H3
InChIKeyJUGKQFUWRSKZKH-UHFFFAOYSA-N
XLogP7.98
TPSA39.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.59
LogP ≤ 57.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole 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

Mahanimbine
CID 167963
8-methoxy-3,3,5-trimethyl-11H-pyrano(3,2-a)carbazole
CID 97487
Girinimbine
CID 96943
Koenidine
CID 278055
Mahanimbicine
CID 4072580
Carbazole Violet
CID 61387
(3R)-3,5-dimethyl-3-(4-methylpent-3-enyl)-11H-pyrano[3,2-a]carbazole
CID 37888682
3,3'-(2-(2-Methoxyphenoxy)ethylazanediyl)bis(1-(9H-carbazol-4-yloxy)propan-2-ol)
CID 20631713
C.I. Pigment Violet 23
CID 11845128
Koenine
CID 5318827
Mukonicine
CID 86242003
Murrastifoline F
CID 10432278

Frequently Asked Questions

What is the IUPAC name of 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole?
The IUPAC name of 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole (CID 14634648) is 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole.
What is the SMILES notation for 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole?
The canonical SMILES for 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole is COc1cc(Cn2c3ccccc3c3cc(C)c4c(c32)C=CC(C)(C)O4)cc2c1[nH]c1ccccc12.
What is the InChIKey of 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole?
The InChIKey is JUGKQFUWRSKZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N2O2/c1-19-15-25-22-10-6-8-12-27(22)34(30(25)23-13-14-32(2,3)36-31(19)23)18-20-16-24-21-9-5-7-11-26(21)33-29(24)28(17-20)35-4/h5-17,33H,18H2,1-4H3.
What are the key properties of 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole?
11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole has a molecular weight of 472.59 g/mol, XLogP of 7.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[(1-methoxy-9H-carbazol-3-yl)methyl]-3,3,5-trimethylpyrano[3,2-a]carbazole is sourced from PubChem (CID 14634648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).