(2,3-dimethyl-1-phenylbut-1-enyl)benzene

C18H20 — CID 15438795

IUPAC(2,3-dimethyl-1-phenylbut-1-enyl)benzene
SMILESCC(=C(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C18H20/c1-14(2)15(3)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,1-3H3
InChIKeyDDQSNEGZUFJWNY-UHFFFAOYSA-N
MW236.36 g/mol
LogP5.16
Rot. Bonds3

About (2,3-dimethyl-1-phenylbut-1-enyl)benzene

(2,3-dimethyl-1-phenylbut-1-enyl)benzene (PubChem CID 15438795) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is (2,3-dimethyl-1-phenylbut-1-enyl)benzene.

Molecular Properties

Compound Name(2,3-dimethyl-1-phenylbut-1-enyl)benzene
PubChem CID15438795
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name(2,3-dimethyl-1-phenylbut-1-enyl)benzene
SMILESCC(=C(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C18H20/c1-14(2)15(3)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,1-3H3
InChIKeyDDQSNEGZUFJWNY-UHFFFAOYSA-N
XLogP5.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (2,3-dimethyl-1-phenylbut-1-enyl)benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(E)-2,3-dimethyl-1-phenylbut-1-enyl]-2-ethenylbenzene
CID 156896551
CID 67882804
CID 67882804
phosphane;1,2,2-triphenylethenylbenzene
CID 157288563
(E)-2,3-dimethyl-N-(methylideneamino)-1-phenylbut-1-en-1-amine
CID 156522918
(1,1-diphenylprop-1-en-2-yl-methyl-phenylphosphaniumyl)boranuide
CID 139090387
4-[1-(4-hydroxyphenyl)-3-methyl-2-phenylbut-1-enyl]phenol
CID 11232780
(2,3-dibromo-1-phenylbut-1-enyl)benzene
CID 13149982
dilithium;hydride;1,2,2-triphenylethenylbenzene
CID 173364079
2-methyl-1-phenylpropan-1-one;1-phenylethanone
CID 162124258
1-[4-[(E)-2-(4-acetylphenyl)-1,2-diphenylethenyl]phenyl]ethanone
CID 10669604
1,1-diphenylprop-1-en-2-yltellanylsodium
CID 134895508
(3,3,3-trifluoro-2-methyl-1-phenylprop-1-enyl)benzene
CID 102368693

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethyl-1-phenylbut-1-enyl)benzene?
The IUPAC name of (2,3-dimethyl-1-phenylbut-1-enyl)benzene (CID 15438795) is (2,3-dimethyl-1-phenylbut-1-enyl)benzene.
What is the SMILES notation for (2,3-dimethyl-1-phenylbut-1-enyl)benzene?
The canonical SMILES for (2,3-dimethyl-1-phenylbut-1-enyl)benzene is CC(=C(c1ccccc1)c1ccccc1)C(C)C.
What is the InChIKey of (2,3-dimethyl-1-phenylbut-1-enyl)benzene?
The InChIKey is DDQSNEGZUFJWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-14(2)15(3)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,1-3H3.
What are the key properties of (2,3-dimethyl-1-phenylbut-1-enyl)benzene?
(2,3-dimethyl-1-phenylbut-1-enyl)benzene has a molecular weight of 236.36 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethyl-1-phenylbut-1-enyl)benzene is sourced from PubChem (CID 15438795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).