4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol

C20H21NO — CID 118449410

IUPAC4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol
SMILESCC1C=CC=CC1C1C=Cc2[nH]c3ccccc3c2C1(C)O
InChIInChI=1S/C20H21NO/c1-13-7-3-4-8-14(13)16-11-12-18-19(20(16,2)22)15-9-5-6-10-17(15)21-18/h3-14,16,21-22H,1-2H3
InChIKeyMCULRNCMOLLNPE-UHFFFAOYSA-N
MW291.39 g/mol
LogP4.40
Rot. Bonds1

About 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol

4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol (PubChem CID 118449410) has the molecular formula C20H21NO and a molecular weight of 291.39 g/mol. Its IUPAC name is 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol.

Molecular Properties

Compound Name4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol
PubChem CID118449410
Molecular FormulaC20H21NO
Molecular Weight291.39 g/mol
Exact Mass291.16
IUPAC Name4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol
SMILESCC1C=CC=CC1C1C=Cc2[nH]c3ccccc3c2C1(C)O
InChIInChI=1S/C20H21NO/c1-13-7-3-4-8-14(13)16-11-12-18-19(20(16,2)22)15-9-5-6-10-17(15)21-18/h3-14,16,21-22H,1-2H3
InChIKeyMCULRNCMOLLNPE-UHFFFAOYSA-N
XLogP4.40
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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10a,11-dihydro-5H-benzo[b]carbazole
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9H-carbazole
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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol?
The IUPAC name of 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol (CID 118449410) is 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol.
What is the SMILES notation for 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol?
The canonical SMILES for 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol is CC1C=CC=CC1C1C=Cc2[nH]c3ccccc3c2C1(C)O.
What is the InChIKey of 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol?
The InChIKey is MCULRNCMOLLNPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO/c1-13-7-3-4-8-14(13)16-11-12-18-19(20(16,2)22)15-9-5-6-10-17(15)21-18/h3-14,16,21-22H,1-2H3.
What are the key properties of 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol?
4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol has a molecular weight of 291.39 g/mol, XLogP of 4.40, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(6-methylcyclohexa-2,4-dien-1-yl)-3,9-dihydrocarbazol-4-ol is sourced from PubChem (CID 118449410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).