5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene

C23H34 — CID 173282541

IUPAC5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene
SMILESCc1cccc2c(C(C)C)c(C(C)C)c(C(C)C)c(C(C)C)c12
InChIInChI=1S/C23H34/c1-13(2)19-18-12-10-11-17(9)23(18)22(16(7)8)21(15(5)6)20(19)14(3)4/h10-16H,1-9H3
InChIKeyCEGSEZWYMPWDQV-UHFFFAOYSA-N
MW310.52 g/mol
LogP7.64
Rot. Bonds4

About 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene

5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene (PubChem CID 173282541) has the molecular formula C23H34 and a molecular weight of 310.52 g/mol. Its IUPAC name is 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene.

Molecular Properties

Compound Name5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene
PubChem CID173282541
Molecular FormulaC23H34
Molecular Weight310.52 g/mol
Exact Mass310.27
IUPAC Name5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene
SMILESCc1cccc2c(C(C)C)c(C(C)C)c(C(C)C)c(C(C)C)c12
InChIInChI=1S/C23H34/c1-13(2)19-18-12-10-11-17(9)23(18)22(16(7)8)21(15(5)6)20(19)14(3)4/h10-16H,1-9H3
InChIKeyCEGSEZWYMPWDQV-UHFFFAOYSA-N
XLogP7.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.52
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,5,12-trimethyltriphenylene
CID 102264978
deuteriomethane;1,3-dimethyl-2-propan-2-ylbenzene;ethane
CID 158876581
8-methyl-4-propan-2-yl-2H-isoquinolin-1-one
CID 115063345
1,5-dimethyl-3-propan-2-ylnaphthalene
CID 102239796
1-chloro-3-methyl-2-propan-2-ylbenzene
CID 20768951
1-methyl-3-(3-methyl-2-propan-2-ylphenoxy)-2-propan-2-ylbenzene
CID 70475927
1,5-dimethylnaphthalene
CID 162159355
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
3-methyl-4-propan-2-ylnaphthalen-1-ol
CID 163727490
3,5-dimethyl-4-(4-methylhexan-2-yl)naphthalen-1-ol
CID 156821260
1,8-dimethyl-2-propan-2-ylnaphthalene
CID 174870278
1-methyldibenzothiophene
CID 23839

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene?
The IUPAC name of 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene (CID 173282541) is 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene.
What is the SMILES notation for 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene?
The canonical SMILES for 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene is Cc1cccc2c(C(C)C)c(C(C)C)c(C(C)C)c(C(C)C)c12.
What is the InChIKey of 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene?
The InChIKey is CEGSEZWYMPWDQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34/c1-13(2)19-18-12-10-11-17(9)23(18)22(16(7)8)21(15(5)6)20(19)14(3)4/h10-16H,1-9H3.
What are the key properties of 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene?
5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene has a molecular weight of 310.52 g/mol, XLogP of 7.64, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,2,3,4-tetra(propan-2-yl)naphthalene is sourced from PubChem (CID 173282541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).