(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone

C25H25NO — CID 45266978

IUPAC(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone
SMILESCCCc1ccc(C(=O)c2cn(CCC)c3ccccc23)c2ccccc12
InChIInChI=1S/C25H25NO/c1-3-9-18-14-15-22(20-11-6-5-10-19(18)20)25(27)23-17-26(16-4-2)24-13-8-7-12-21(23)24/h5-8,10-15,17H,3-4,9,16H2,1-2H3
InChIKeyBMOMWXXAVVSIRU-UHFFFAOYSA-N
MW355.48 g/mol
LogP6.39
Rot. Bonds6

About (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone

(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone (PubChem CID 45266978) has the molecular formula C25H25NO and a molecular weight of 355.48 g/mol. Its IUPAC name is (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone.

Molecular Properties

Compound Name(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone
PubChem CID45266978
Molecular FormulaC25H25NO
Molecular Weight355.48 g/mol
Exact Mass355.19
IUPAC Name(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone
SMILESCCCc1ccc(C(=O)c2cn(CCC)c3ccccc23)c2ccccc12
InChIInChI=1S/C25H25NO/c1-3-9-18-14-15-22(20-11-6-5-10-19(18)20)25(27)23-17-26(16-4-2)24-13-8-7-12-21(23)24/h5-8,10-15,17H,3-4,9,16H2,1-2H3
InChIKeyBMOMWXXAVVSIRU-UHFFFAOYSA-N
XLogP6.39
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.48
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Jwh 018
CID 10382701
(1-Butyl-1H-indol-3-yl)-1-naphthalenylmethanone
CID 10471670
Jwh 122
CID 44466638
Jwh-200
CID 10045570
Xlr 11
CID 57501498
Jwh 015
CID 4273754
(4-Ethyl-1-naphthalenyl)(1-pentyl-1H-indol-3-yl)methanone
CID 45270396
AM 2201
CID 53393997
(1-pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 44626619
AM-694
CID 9889172
Jwh 307
CID 16049783
Jwh 203
CID 44397500

Frequently Asked Questions

What is the IUPAC name of (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone?
The IUPAC name of (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone (CID 45266978) is (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone.
What is the SMILES notation for (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone?
The canonical SMILES for (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone is CCCc1ccc(C(=O)c2cn(CCC)c3ccccc23)c2ccccc12.
What is the InChIKey of (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone?
The InChIKey is BMOMWXXAVVSIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO/c1-3-9-18-14-15-22(20-11-6-5-10-19(18)20)25(27)23-17-26(16-4-2)24-13-8-7-12-21(23)24/h5-8,10-15,17H,3-4,9,16H2,1-2H3.
What are the key properties of (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone?
(1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone has a molecular weight of 355.48 g/mol, XLogP of 6.39, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone is sourced from PubChem (CID 45266978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).