1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol

C14H15NO — CID 172715661

IUPAC1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol
SMILESCn1c(O)cc2cc3c(cc21)C=CCCC3
InChIInChI=1S/C14H15NO/c1-15-13-8-11-6-4-2-3-5-10(11)7-12(13)9-14(15)16/h4,6-9,16H,2-3,5H2,1H3
InChIKeyFVEQTQSMJAFNJF-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.23
Rot. Bonds

About 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol

1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol (PubChem CID 172715661) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol.

Molecular Properties

Compound Name1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol
PubChem CID172715661
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol
SMILESCn1c(O)cc2cc3c(cc21)C=CCCC3
InChIInChI=1S/C14H15NO/c1-15-13-8-11-6-4-2-3-5-10(11)7-12(13)9-14(15)16/h4,6-9,16H,2-3,5H2,1H3
InChIKeyFVEQTQSMJAFNJF-UHFFFAOYSA-N
XLogP3.23
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol?
The IUPAC name of 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol (CID 172715661) is 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol.
What is the SMILES notation for 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol?
The canonical SMILES for 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol is Cn1c(O)cc2cc3c(cc21)C=CCCC3.
What is the InChIKey of 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol?
The InChIKey is FVEQTQSMJAFNJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-15-13-8-11-6-4-2-3-5-10(11)7-12(13)9-14(15)16/h4,6-9,16H,2-3,5H2,1H3.
What are the key properties of 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol?
1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol has a molecular weight of 213.28 g/mol, XLogP of 3.23, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6,7-dihydro-5H-cyclohepta[f]indol-2-ol is sourced from PubChem (CID 172715661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).