1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene

C16H24 — CID 142205633

IUPAC1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene
SMILESCCC(C)(C)c1c(C)cc(C)cc1C1CC1
InChIInChI=1S/C16H24/c1-6-16(4,5)15-12(3)9-11(2)10-14(15)13-7-8-13/h9-10,13H,6-8H2,1-5H3
InChIKeyYDEQQWIENYNPIC-UHFFFAOYSA-N
MW216.37 g/mol
LogP4.87
Rot. Bonds3

About 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene

1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene (PubChem CID 142205633) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene.

Molecular Properties

Compound Name1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene
PubChem CID142205633
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene
SMILESCCC(C)(C)c1c(C)cc(C)cc1C1CC1
InChIInChI=1S/C16H24/c1-6-16(4,5)15-12(3)9-11(2)10-14(15)13-7-8-13/h9-10,13H,6-8H2,1-5H3
InChIKeyYDEQQWIENYNPIC-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-tert-butyl-1,3-dicyclopropyl-5-methylbenzene
CID 161279154
2-(2,4,6-trimethylphenyl)butan-2-ol
CID 91656781
2,4-dimethyl-6-[4-[2-[4-(2,3,5-trimethylphenyl)cyclohexyl]propan-2-yl]cyclohexyl]phenol
CID 145238129
3-(2,2-dimethylpropyl)-5,7-dimethyl-2,3-dihydro-1H-indole
CID 106985792
2-cyclopropyl-6-ethyl-4-methylbenzaldehyde
CID 87214087
4-(2,3,5-trimethylphenyl)piperidine
CID 117292122
[2-methyl-2-(2,4,6-trimethylphenyl)propyl]carbamic acid
CID 115171394
(4S)-6,8-dimethyl-3,4-dihydro-2H-chromen-4-amine
CID 42220750
3,5-dimethyl-2-(2-methylpentan-2-yl)phenol
CID 118028317
1,3-dicyclohexyl-2,5-dimethylbenzene
CID 91568948
disodium;[3,5-dimethyl-2-(2-methylbutan-2-yl)phenyl] acetate;dioxido-oxo-sulfanylidene-λ6-sulfane
CID 175147861
4-(2-aminooxy-4,6-dimethylphenyl)-4-methylpentan-2-one
CID 163410720

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene?
The IUPAC name of 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene (CID 142205633) is 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene.
What is the SMILES notation for 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene?
The canonical SMILES for 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene is CCC(C)(C)c1c(C)cc(C)cc1C1CC1.
What is the InChIKey of 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene?
The InChIKey is YDEQQWIENYNPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-6-16(4,5)15-12(3)9-11(2)10-14(15)13-7-8-13/h9-10,13H,6-8H2,1-5H3.
What are the key properties of 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene?
1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene has a molecular weight of 216.37 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3,5-dimethyl-2-(2-methylbutan-2-yl)benzene is sourced from PubChem (CID 142205633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).