2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol

C14H17NO — CID 2874344

IUPAC2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol
SMILESCc1ccc2[nH]c3c(c2c1)CCCCC3O
InChIInChI=1S/C14H17NO/c1-9-6-7-12-11(8-9)10-4-2-3-5-13(16)14(10)15-12/h6-8,13,15-16H,2-5H2,1H3
InChIKeyZSUMOIQSYGLLID-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.24
Rot. Bonds

About 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol

2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol (PubChem CID 2874344) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol.

Molecular Properties

Compound Name2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol
PubChem CID2874344
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol
SMILESCc1ccc2[nH]c3c(c2c1)CCCCC3O
InChIInChI=1S/C14H17NO/c1-9-6-7-12-11(8-9)10-4-2-3-5-13(16)14(10)15-12/h6-8,13,15-16H,2-5H2,1H3
InChIKeyZSUMOIQSYGLLID-UHFFFAOYSA-N
XLogP3.24
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

7-methyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-ol
CID 2849427
cyclohexyl-(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)azanium
CID 4105832
[(1S)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
CID 6575411
(1S)-N-cyclohexyl-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 753921
N-[(4-fluorophenyl)methyl]-2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-amine
CID 59014653
2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]ethanol;hydrochloride
CID 14197121
(4-fluorophenyl)methyl-[(1S)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]azanium
CID 6943815
7-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole
CID 4770206
(4-chlorophenyl)methyl-[(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]azanium
CID 7047389
1-cyclobutyl-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
CID 141010505
8-methyl-1,2,3,5-tetrahydrocyclopenta[c]quinolin-4-one
CID 22462487
cyclohexyl-[(1R)-1,6-dimethyl-2,3,4,9-tetrahydrocarbazol-1-yl]azanium
CID 7372508

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol?
The IUPAC name of 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol (CID 2874344) is 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol.
What is the SMILES notation for 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol?
The canonical SMILES for 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol is Cc1ccc2[nH]c3c(c2c1)CCCCC3O.
What is the InChIKey of 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol?
The InChIKey is ZSUMOIQSYGLLID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-9-6-7-12-11(8-9)10-4-2-3-5-13(16)14(10)15-12/h6-8,13,15-16H,2-5H2,1H3.
What are the key properties of 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol?
2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol has a molecular weight of 215.30 g/mol, XLogP of 3.24, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-6-ol is sourced from PubChem (CID 2874344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).