(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole

C32H30N2O2 — CID 163187471

IUPAC(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole
SMILESCOc1cc(C)c([C@H]2CC(C)(C)Oc3c(C)cc4c([nH]c5ccccc54)c32)c2c1[nH]c1ccccc12
InChIInChI=1S/C32H30N2O2/c1-17-15-25(35-5)30-27(20-11-7-9-13-24(20)34-30)26(17)22-16-32(3,4)36-31-18(2)14-21-19-10-6-8-12-23(19)33-29(21)28(22)31/h6-15,22,33-34H,16H2,1-5H3/t22-/m1/s1
InChIKeyCKHKPKVINSAUNM-JOCHJYFZSA-N
MW474.60 g/mol
LogP8.27
Rot. Bonds2

About (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole

(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole (PubChem CID 163187471) has the molecular formula C32H30N2O2 and a molecular weight of 474.60 g/mol. Its IUPAC name is (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole.

Molecular Properties

Compound Name(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole
PubChem CID163187471
Molecular FormulaC32H30N2O2
Molecular Weight474.60 g/mol
Exact Mass474.23
IUPAC Name(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole
SMILESCOc1cc(C)c([C@H]2CC(C)(C)Oc3c(C)cc4c([nH]c5ccccc54)c32)c2c1[nH]c1ccccc12
InChIInChI=1S/C32H30N2O2/c1-17-15-25(35-5)30-27(20-11-7-9-13-24(20)34-30)26(17)22-16-32(3,4)36-31-18(2)14-21-19-10-6-8-12-23(19)33-29(21)28(22)31/h6-15,22,33-34H,16H2,1-5H3/t22-/m1/s1
InChIKeyCKHKPKVINSAUNM-JOCHJYFZSA-N
XLogP8.27
TPSA50.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.60
LogP ≤ 58.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[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

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole?
The IUPAC name of (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole (CID 163187471) is (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole.
What is the SMILES notation for (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole?
The canonical SMILES for (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole is COc1cc(C)c([C@H]2CC(C)(C)Oc3c(C)cc4c([nH]c5ccccc54)c32)c2c1[nH]c1ccccc12.
What is the InChIKey of (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole?
The InChIKey is CKHKPKVINSAUNM-JOCHJYFZSA-N. The full InChI is InChI=1S/C32H30N2O2/c1-17-15-25(35-5)30-27(20-11-7-9-13-24(20)34-30)26(17)22-16-32(3,4)36-31-18(2)14-21-19-10-6-8-12-23(19)33-29(21)28(22)31/h6-15,22,33-34H,16H2,1-5H3/t22-/m1/s1.
What are the key properties of (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole?
(1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole has a molecular weight of 474.60 g/mol, XLogP of 8.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(1-methoxy-3-methyl-9H-carbazol-4-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole is sourced from PubChem (CID 163187471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).