9-methyl-2,3-dihydro-1H-phenanthren-4-one

C15H14O — CID 24975203

IUPAC9-methyl-2,3-dihydro-1H-phenanthren-4-one
SMILESCc1cc2c(c3ccccc13)C(=O)CCC2
InChIInChI=1S/C15H14O/c1-10-9-11-5-4-8-14(16)15(11)13-7-3-2-6-12(10)13/h2-3,6-7,9H,4-5,8H2,1H3
InChIKeyFEPAIVKUNJKRMJ-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.67
Rot. Bonds

About 9-methyl-2,3-dihydro-1H-phenanthren-4-one

9-methyl-2,3-dihydro-1H-phenanthren-4-one (PubChem CID 24975203) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is 9-methyl-2,3-dihydro-1H-phenanthren-4-one.

Molecular Properties

Compound Name9-methyl-2,3-dihydro-1H-phenanthren-4-one
PubChem CID24975203
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name9-methyl-2,3-dihydro-1H-phenanthren-4-one
SMILESCc1cc2c(c3ccccc13)C(=O)CCC2
InChIInChI=1S/C15H14O/c1-10-9-11-5-4-8-14(16)15(11)13-7-3-2-6-12(10)13/h2-3,6-7,9H,4-5,8H2,1H3
InChIKeyFEPAIVKUNJKRMJ-UHFFFAOYSA-N
XLogP3.67
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 10631089
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CID 12582397
7-chloro-6-methyl-3,4-dihydro-2H-naphthalen-1-one
CID 55297419
5-methylbenzo[e]isoindole-1,3-dione
CID 132606674
8,9-dimethyl-2,3-dihydro-1H-carbazol-4-one
CID 84739991
(12,12,15-trimethyl-17-oxo-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16(21)-octaenyl) acetate
CID 118083699
9,10-bis(2,4,6-trimethylanilino)-2,3-dihydroanthracene-1,4-dione
CID 11134566
1,2,6,7-tetrahydroindeno[7,6-g]indene-3,8-dione
CID 118516621
3-methyl-6,7-dihydro-5H-2-benzofuran-4-one
CID 82417491
7-methoxy-6-methyl-3,4-dihydro-2H-naphthalen-1-one
CID 10241621
5,9-dimethyl-7H-benzo[c]fluorene;2,7-dimethyl-9H-fluorene;9,15-dimethylpentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;ethane
CID 158732726
6-ethyl-10,11-dihydro-9H-benzo[a]anthracen-8-one
CID 125464395

Frequently Asked Questions

What is the IUPAC name of 9-methyl-2,3-dihydro-1H-phenanthren-4-one?
The IUPAC name of 9-methyl-2,3-dihydro-1H-phenanthren-4-one (CID 24975203) is 9-methyl-2,3-dihydro-1H-phenanthren-4-one.
What is the SMILES notation for 9-methyl-2,3-dihydro-1H-phenanthren-4-one?
The canonical SMILES for 9-methyl-2,3-dihydro-1H-phenanthren-4-one is Cc1cc2c(c3ccccc13)C(=O)CCC2.
What is the InChIKey of 9-methyl-2,3-dihydro-1H-phenanthren-4-one?
The InChIKey is FEPAIVKUNJKRMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O/c1-10-9-11-5-4-8-14(16)15(11)13-7-3-2-6-12(10)13/h2-3,6-7,9H,4-5,8H2,1H3.
What are the key properties of 9-methyl-2,3-dihydro-1H-phenanthren-4-one?
9-methyl-2,3-dihydro-1H-phenanthren-4-one has a molecular weight of 210.28 g/mol, XLogP of 3.67, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2,3-dihydro-1H-phenanthren-4-one is sourced from PubChem (CID 24975203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).