(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone

C15H12N2O — CID 60660061

IUPAC(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone
SMILESCn1ccnc1C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H12N2O/c1-17-9-8-16-15(17)14(18)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3
InChIKeySZPNRUMBNUDESX-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.80
Rot. Bonds2

About (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone

(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone (PubChem CID 60660061) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone.

Molecular Properties

Compound Name(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone
PubChem CID60660061
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone
SMILESCn1ccnc1C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H12N2O/c1-17-9-8-16-15(17)14(18)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3
InChIKeySZPNRUMBNUDESX-UHFFFAOYSA-N
XLogP2.80
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dichloro-4-pyridinyl)-(1-methylimidazol-2-yl)methanone
CID 54233902
(1-methylimidazol-2-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 5303840
dinaphthalen-2-ylmethanone
CID 10945915
(1-methylimidazol-2-yl)-(6-methyl-3-pyridinyl)methanone
CID 112731494
[2-(aminomethyl)-4-pyridinyl]-(1-methylimidazol-2-yl)methanone
CID 116601746
[3-(2-aminoethoxy)phenyl]-(1-methylimidazol-2-yl)methanone
CID 96662606
3,3-dimethyl-5-(1-methylimidazole-2-carbonyl)-1H-indol-2-one
CID 82487900
tris(bis(1-methylimidazol-2-yl)methanone);iron(2+);dichloride;hexahydrate
CID 139059297
(1-methylimidazol-2-yl)-[3-nitro-4-[2-(quinolin-2-ylamino)ethylamino]phenyl]methanone
CID 133309783
4-methoxy-N-[4-(1-methylimidazole-2-carbonyl)phenyl]benzamide
CID 17427516
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138

Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone?
The IUPAC name of (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone (CID 60660061) is (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone.
What is the SMILES notation for (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone?
The canonical SMILES for (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone is Cn1ccnc1C(=O)c1ccc2ccccc2c1.
What is the InChIKey of (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone?
The InChIKey is SZPNRUMBNUDESX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-17-9-8-16-15(17)14(18)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3.
What are the key properties of (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone?
(1-methylimidazol-2-yl)-naphthalen-2-ylmethanone has a molecular weight of 236.27 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-2-yl)-naphthalen-2-ylmethanone is sourced from PubChem (CID 60660061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).