2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene

C30H26 — CID 145390572

IUPAC2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene
SMILESCc1ccccc1-c1c(C)c(C)c(-c2c(C)ccc3ccccc23)c2ccccc12
InChIInChI=1S/C30H26/c1-19-11-5-7-13-24(19)29-21(3)22(4)30(27-16-10-9-15-26(27)29)28-20(2)17-18-23-12-6-8-14-25(23)28/h5-18H,1-4H3
InChIKeyPCVZWMPWMFJJQH-UHFFFAOYSA-N
MW386.54 g/mol
LogP8.56
Rot. Bonds2

About 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene

2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene (PubChem CID 145390572) has the molecular formula C30H26 and a molecular weight of 386.54 g/mol. Its IUPAC name is 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene.

Molecular Properties

Compound Name2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene
PubChem CID145390572
Molecular FormulaC30H26
Molecular Weight386.54 g/mol
Exact Mass386.20
IUPAC Name2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene
SMILESCc1ccccc1-c1c(C)c(C)c(-c2c(C)ccc3ccccc23)c2ccccc12
InChIInChI=1S/C30H26/c1-19-11-5-7-13-24(19)29-21(3)22(4)30(27-16-10-9-15-26(27)29)28-20(2)17-18-23-12-6-8-14-25(23)28/h5-18H,1-4H3
InChIKeyPCVZWMPWMFJJQH-UHFFFAOYSA-N
XLogP8.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.54
LogP ≤ 58.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene?
The IUPAC name of 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene (CID 145390572) is 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene.
What is the SMILES notation for 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene?
The canonical SMILES for 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene is Cc1ccccc1-c1c(C)c(C)c(-c2c(C)ccc3ccccc23)c2ccccc12.
What is the InChIKey of 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene?
The InChIKey is PCVZWMPWMFJJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26/c1-19-11-5-7-13-24(19)29-21(3)22(4)30(27-16-10-9-15-26(27)29)28-20(2)17-18-23-12-6-8-14-25(23)28/h5-18H,1-4H3.
What are the key properties of 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene?
2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene has a molecular weight of 386.54 g/mol, XLogP of 8.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(2-methylnaphthalen-1-yl)-4-(2-methylphenyl)naphthalene is sourced from PubChem (CID 145390572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).