2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one

C15H16O — CID 13199366

IUPAC2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)C(C)C)ccc2c1
InChIInChI=1S/C15H16O/c1-10(2)15(16)14-7-6-12-8-11(3)4-5-13(12)9-14/h4-10H,1-3H3
InChIKeyZBLNATUBDRHICA-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.99
Rot. Bonds2

About 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one

2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one (PubChem CID 13199366) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one.

Molecular Properties

Compound Name2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one
PubChem CID13199366
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)C(C)C)ccc2c1
InChIInChI=1S/C15H16O/c1-10(2)15(16)14-7-6-12-8-11(3)4-5-13(12)9-14/h4-10H,1-3H3
InChIKeyZBLNATUBDRHICA-UHFFFAOYSA-N
XLogP3.99
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-4-(6-methylnaphthalen-2-yl)-4-oxobutanoic acid
CID 116918330
1-(6-bromonaphthalen-2-yl)-2-methylpropan-1-one
CID 114962080
2,2-dimethyl-1-[6-(2-methylpropanoyl)naphthalen-2-yl]propan-1-one
CID 144517477
3-amino-4-(6-methylnaphthalen-2-yl)-4-oxobutanoic acid
CID 116920774
mercury(2+);bis(6-methylnaphthalene-2-carboxylate)
CID 22604897
2-(6-methylnaphthalen-2-yl)-2-oxoacetaldehyde
CID 15032601
2-bromo-1-(6-methylnaphthalen-2-yl)ethanone
CID 12698900
CID 88929951
CID 88929951
2,2-bis(4-methylphenyl)-1-naphthalen-2-ylethanone
CID 56956568
(6-methylnaphthalen-1-yl) 6-methylnaphthalene-2-carboxylate
CID 21292340
(2S)-2-hydroxy-1-naphthalen-2-ylpropan-1-one
CID 10130388
3-amino-1-(6-methylnaphthalen-2-yl)propan-1-one
CID 116915436

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one?
The IUPAC name of 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one (CID 13199366) is 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one.
What is the SMILES notation for 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one?
The canonical SMILES for 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one is Cc1ccc2cc(C(=O)C(C)C)ccc2c1.
What is the InChIKey of 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one?
The InChIKey is ZBLNATUBDRHICA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-10(2)15(16)14-7-6-12-8-11(3)4-5-13(12)9-14/h4-10H,1-3H3.
What are the key properties of 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one?
2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one has a molecular weight of 212.29 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(6-methylnaphthalen-2-yl)propan-1-one is sourced from PubChem (CID 13199366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).