[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane

C15H28 — CID 173203928

IUPAC[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane
SMILESCCC(C)(C)C(CCC1CC1)CC1CC1
InChIInChI=1S/C15H28/c1-4-15(2,3)14(11-13-7-8-13)10-9-12-5-6-12/h12-14H,4-11H2,1-3H3
InChIKeyDTMLWQHIIXJNKI-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.03
Rot. Bonds7

About [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane

[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane (PubChem CID 173203928) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane.

Molecular Properties

Compound Name[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane
PubChem CID173203928
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane
SMILESCCC(C)(C)C(CCC1CC1)CC1CC1
InChIInChI=1S/C15H28/c1-4-15(2,3)14(11-13-7-8-13)10-9-12-5-6-12/h12-14H,4-11H2,1-3H3
InChIKeyDTMLWQHIIXJNKI-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4,5,5-trimethylheptylcyclopropane
CID 123484430
1-(3-tert-butylhexyl)-4-heptan-4-ylcyclohexane
CID 143289230
3-ethylpentylcyclopropane
CID 91030831
1-cyclobutyl-3,3-dimethylpentan-2-ol
CID 115802513
4-[2-(cyclohexylmethyl)-3,3-dimethylpentyl]pyridine
CID 56990572
4-(2-ethyl-3,3-dimethylbutyl)cyclohexan-1-ol
CID 22486950
3-methylpentylcyclopropane
CID 56979389
1-(3,3-dimethylpentan-2-yl)-3-propylcyclobutane
CID 123502535
1-cyclopropylheptane-3,4-diol
CID 103455036
1-cyclopropyl-4-ethoxy-4-methylhexan-3-ol
CID 116752325
(2R)-4-cyclopropylbutan-2-amine
CID 95367313
3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159602512

Frequently Asked Questions

What is the IUPAC name of [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane?
The IUPAC name of [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane (CID 173203928) is [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane.
What is the SMILES notation for [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane?
The canonical SMILES for [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane is CCC(C)(C)C(CCC1CC1)CC1CC1.
What is the InChIKey of [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane?
The InChIKey is DTMLWQHIIXJNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-4-15(2,3)14(11-13-7-8-13)10-9-12-5-6-12/h12-14H,4-11H2,1-3H3.
What are the key properties of [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane?
[2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane has a molecular weight of 208.39 g/mol, XLogP of 5.03, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-cyclopropylethyl)-3,3-dimethylpentyl]cyclopropane is sourced from PubChem (CID 173203928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).