2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene

C26H26 — CID 59336410

IUPAC2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene
SMILESCCCc1ccc2ccccc2c1-c1c(CCC)ccc2ccccc12
InChIInChI=1S/C26H26/c1-3-9-21-17-15-19-11-5-7-13-23(19)25(21)26-22(10-4-2)18-16-20-12-6-8-14-24(20)26/h5-8,11-18H,3-4,9-10H2,1-2H3
InChIKeyBHVKBIYMOGQLJR-UHFFFAOYSA-N
MW338.49 g/mol
LogP7.57
Rot. Bonds5

About 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene

2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene (PubChem CID 59336410) has the molecular formula C26H26 and a molecular weight of 338.49 g/mol. Its IUPAC name is 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene.

Molecular Properties

Compound Name2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene
PubChem CID59336410
Molecular FormulaC26H26
Molecular Weight338.49 g/mol
Exact Mass338.20
IUPAC Name2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene
SMILESCCCc1ccc2ccccc2c1-c1c(CCC)ccc2ccccc12
InChIInChI=1S/C26H26/c1-3-9-21-17-15-19-11-5-7-13-23(19)25(21)26-22(10-4-2)18-16-20-12-6-8-14-24(20)26/h5-8,11-18H,3-4,9-10H2,1-2H3
InChIKeyBHVKBIYMOGQLJR-UHFFFAOYSA-N
XLogP7.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.49
LogP ≤ 57.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-phenyl-2-propylnaphthalene
CID 102463751
2-butyl-1-(2-butylnaphthalen-1-yl)naphthalene
CID 59129933
2-[1-[2-(2-hydroxyethyl)naphthalen-1-yl]naphthalen-2-yl]ethanol
CID 10405122
1-methoxy-2-propylnaphthalene
CID 19091368
2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine
CID 101269623
methanamine;1-propylnaphthalene
CID 174438724
2-[1-(3,4-dipropyl-1H-phosphol-2-yl)naphthalen-2-yl]-3,4-dipropyl-1H-phosphole
CID 161434762
1-nitro-2-propylnaphthalene
CID 19077753
2-pentyl-1-propylnaphthalene
CID 173391876
ethane;phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
CID 159820370
2-hexyl-1-propylnaphthalene
CID 173300538
phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
CID 21335479

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene?
The IUPAC name of 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene (CID 59336410) is 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene.
What is the SMILES notation for 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene?
The canonical SMILES for 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene is CCCc1ccc2ccccc2c1-c1c(CCC)ccc2ccccc12.
What is the InChIKey of 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene?
The InChIKey is BHVKBIYMOGQLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26/c1-3-9-21-17-15-19-11-5-7-13-23(19)25(21)26-22(10-4-2)18-16-20-12-6-8-14-24(20)26/h5-8,11-18H,3-4,9-10H2,1-2H3.
What are the key properties of 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene?
2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene has a molecular weight of 338.49 g/mol, XLogP of 7.57, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene is sourced from PubChem (CID 59336410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).