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

C19H14N2O — CID 134131985

IUPAC(2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone
SMILESCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
InChIInChI=1S/C19H14N2O/c1-13-20-17-11-4-5-12-18(17)21(13)19(22)16-10-6-8-14-7-2-3-9-15(14)16/h2-12H,1H3
InChIKeyMBCLKEZDZBEIIE-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.19
Rot. Bonds1

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

(2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone (PubChem CID 134131985) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name(2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone
PubChem CID134131985
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC Name(2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone
SMILESCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
InChIInChI=1S/C19H14N2O/c1-13-20-17-11-4-5-12-18(17)21(13)19(22)16-10-6-8-14-7-2-3-9-15(14)16/h2-12H,1H3
InChIKeyMBCLKEZDZBEIIE-UHFFFAOYSA-N
XLogP4.19
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone?
The IUPAC name of (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone (CID 134131985) is (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone.
What is the SMILES notation for (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone?
The canonical SMILES for (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone is Cc1nc2ccccc2n1C(=O)c1cccc2ccccc12.
What is the InChIKey of (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone?
The InChIKey is MBCLKEZDZBEIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O/c1-13-20-17-11-4-5-12-18(17)21(13)19(22)16-10-6-8-14-7-2-3-9-15(14)16/h2-12H,1H3.
What are the key properties of (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone?
(2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone has a molecular weight of 286.33 g/mol, XLogP of 4.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylbenzimidazol-1-yl)-naphthalen-1-ylmethanone is sourced from PubChem (CID 134131985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).