1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene

C26H24 — CID 140715231

IUPAC1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene
SMILESCC(C)c1ccc(C(c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C26H24/c1-19(2)20-15-17-23(18-16-20)26(22-10-4-3-5-11-22)25-14-8-12-21-9-6-7-13-24(21)25/h3-19,26H,1-2H3
InChIKeyBWCZVJZZNHZKEX-UHFFFAOYSA-N
MW336.48 g/mol
LogP7.14
Rot. Bonds4

About 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene

1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene (PubChem CID 140715231) has the molecular formula C26H24 and a molecular weight of 336.48 g/mol. Its IUPAC name is 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene.

Molecular Properties

Compound Name1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene
PubChem CID140715231
Molecular FormulaC26H24
Molecular Weight336.48 g/mol
Exact Mass336.19
IUPAC Name1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene
SMILESCC(C)c1ccc(C(c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C26H24/c1-19(2)20-15-17-23(18-16-20)26(22-10-4-3-5-11-22)25-14-8-12-21-9-6-7-13-24(21)25/h3-19,26H,1-2H3
InChIKeyBWCZVJZZNHZKEX-UHFFFAOYSA-N
XLogP7.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

1-[(4-methoxyphenyl)-phenylmethyl]naphthalene
CID 19697043
1-[[4-[4-[4-[bis(4-phenylphenyl)methyl]phenyl]phenyl]phenyl]-phenylmethyl]naphthalene;1-[[4-[4-[[4-[4-[naphthalen-1-yl(phenyl)methyl]phenyl]phenyl]-phenylmethyl]phenyl]phenyl]-phenylmethyl]naphthalene
CID 91356771
1-methylnaphthalene;1-[[4-(4-methylphenyl)phenyl]-phenylmethyl]naphthalene;toluene
CID 142867953
carbanide;cumene;ethane;methane;1-propan-2-ylnaphthalene;2-propan-2-ylnaphthalene;tris(yttrium)
CID 158874697
ethane;methane;1-propan-2-ylnaphthalene
CID 160778548
(1S)-N-(1-naphthalen-1-ylethyl)-1-phenylethanamine
CID 78956224
(1R,2S)-1-naphthalen-1-yl-2-phenylpropan-1-ol
CID 11161331
butane;1-propan-2-ylnaphthalene
CID 157253186
benzene;cumene
CID 157215889
cumene
CID 161227923
propan-2-ylcyclodecapentaene
CID 123508933
1-[[4-[4-(1H-inden-2-yl)phenyl]phenyl]-phenylmethyl]naphthalene
CID 58568788

Frequently Asked Questions

What is the IUPAC name of 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene?
The IUPAC name of 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene (CID 140715231) is 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene.
What is the SMILES notation for 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene?
The canonical SMILES for 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene is CC(C)c1ccc(C(c2ccccc2)c2cccc3ccccc23)cc1.
What is the InChIKey of 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene?
The InChIKey is BWCZVJZZNHZKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24/c1-19(2)20-15-17-23(18-16-20)26(22-10-4-3-5-11-22)25-14-8-12-21-9-6-7-13-24(21)25/h3-19,26H,1-2H3.
What are the key properties of 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene?
1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene has a molecular weight of 336.48 g/mol, XLogP of 7.14, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[phenyl-(4-propan-2-ylphenyl)methyl]naphthalene is sourced from PubChem (CID 140715231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).