3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one

C14H15NO2 — CID 164597936

IUPAC3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one
SMILESCn1c(=O)c2c(c3ccc(O)cc31)CCCC2
InChIInChI=1S/C14H15NO2/c1-15-13-8-9(16)6-7-11(13)10-4-2-3-5-12(10)14(15)17/h6-8,16H,2-5H2,1H3
InChIKeyMEUALDDWHCGKQV-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.12
Rot. Bonds

About 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one

3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one (PubChem CID 164597936) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one.

Molecular Properties

Compound Name3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one
PubChem CID164597936
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one
SMILESCn1c(=O)c2c(c3ccc(O)cc31)CCCC2
InChIInChI=1S/C14H15NO2/c1-15-13-8-9(16)6-7-11(13)10-4-2-3-5-12(10)14(15)17/h6-8,16H,2-5H2,1H3
InChIKeyMEUALDDWHCGKQV-UHFFFAOYSA-N
XLogP2.12
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 159244934
CID 159244934
4-butoxy-7-hydroxy-1-methyl-3-octoxyquinolin-2-one
CID 139717001
7-hydroxy-1-methyl-3-piperidin-4-ylquinazoline-2,4-dione;hydrobromide
CID 22923480
7-hydroxy-1-methyl-3-pyrrolidin-3-ylquinazoline-2,4-dione
CID 117262818
1,3-dimethylindol-6-ol
CID 83815731
7-hydroxy-1-methyl-4-phenylmethoxy-3-propan-2-yloxyquinolin-2-one
CID 139718369
(7-hydroxy-1-methyl-2-oxo-4-phenylmethoxyquinolin-3-yl) acetate
CID 139717866
3-iodo-1-methylindazol-6-ol
CID 136948963
dimethyl 2-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)propanedioate
CID 11088358
5-tert-butyl-3,8-dihydroxyphenanthridin-6-one
CID 164598717
9-methyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide
CID 84613100
5-cyclopropyl-3,8-dihydroxy-9-methylphenanthridin-6-one
CID 164598275

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one?
The IUPAC name of 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one (CID 164597936) is 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one.
What is the SMILES notation for 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one?
The canonical SMILES for 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one is Cn1c(=O)c2c(c3ccc(O)cc31)CCCC2.
What is the InChIKey of 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one?
The InChIKey is MEUALDDWHCGKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-15-13-8-9(16)6-7-11(13)10-4-2-3-5-12(10)14(15)17/h6-8,16H,2-5H2,1H3.
What are the key properties of 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one?
3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one has a molecular weight of 229.28 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-methyl-7,8,9,10-tetrahydrophenanthridin-6-one is sourced from PubChem (CID 164597936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).