(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone

C24H23NO — CID 11473309

IUPAC(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone
SMILESCCCn1c(C)c(C(=O)c2cccc3ccc(C)cc23)c2ccccc21
InChIInChI=1S/C24H23NO/c1-4-14-25-17(3)23(20-9-5-6-11-22(20)25)24(26)19-10-7-8-18-13-12-16(2)15-21(18)19/h5-13,15H,4,14H2,1-3H3
InChIKeyAYSKEJYDZUJEIT-UHFFFAOYSA-N
MW341.45 g/mol
LogP6.05
Rot. Bonds4

About (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone

(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone (PubChem CID 11473309) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone.

Molecular Properties

Compound Name(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone
PubChem CID11473309
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC Name(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone
SMILESCCCn1c(C)c(C(=O)c2cccc3ccc(C)cc23)c2ccccc21
InChIInChI=1S/C24H23NO/c1-4-14-25-17(3)23(20-9-5-6-11-22(20)25)24(26)19-10-7-8-18-13-12-16(2)15-21(18)19/h5-13,15H,4,14H2,1-3H3
InChIKeyAYSKEJYDZUJEIT-UHFFFAOYSA-N
XLogP6.05
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.45
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone?
The IUPAC name of (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone (CID 11473309) is (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone.
What is the SMILES notation for (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone?
The canonical SMILES for (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone is CCCn1c(C)c(C(=O)c2cccc3ccc(C)cc23)c2ccccc21.
What is the InChIKey of (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone?
The InChIKey is AYSKEJYDZUJEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO/c1-4-14-25-17(3)23(20-9-5-6-11-22(20)25)24(26)19-10-7-8-18-13-12-16(2)15-21(18)19/h5-13,15H,4,14H2,1-3H3.
What are the key properties of (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone?
(7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone has a molecular weight of 341.45 g/mol, XLogP of 6.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone is sourced from PubChem (CID 11473309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).