(3-ethyl-4,5-dimethylheptyl)cyclopropane

C14H28 — CID 123809704

IUPAC(3-ethyl-4,5-dimethylheptyl)cyclopropane
SMILESCCC(C)C(C)C(CC)CCC1CC1
InChIInChI=1S/C14H28/c1-5-11(3)12(4)14(6-2)10-9-13-7-8-13/h11-14H,5-10H2,1-4H3
InChIKeyOUJVJLAJGBWDKK-UHFFFAOYSA-N
MW196.38 g/mol
LogP4.89
Rot. Bonds7

About (3-ethyl-4,5-dimethylheptyl)cyclopropane

(3-ethyl-4,5-dimethylheptyl)cyclopropane (PubChem CID 123809704) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is (3-ethyl-4,5-dimethylheptyl)cyclopropane.

Molecular Properties

Compound Name(3-ethyl-4,5-dimethylheptyl)cyclopropane
PubChem CID123809704
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name(3-ethyl-4,5-dimethylheptyl)cyclopropane
SMILESCCC(C)C(C)C(CC)CCC1CC1
InChIInChI=1S/C14H28/c1-5-11(3)12(4)14(6-2)10-9-13-7-8-13/h11-14H,5-10H2,1-4H3
InChIKeyOUJVJLAJGBWDKK-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.38
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (3-ethyl-4,5-dimethylheptyl)cyclopropane 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-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
CID 123532559
3-methylpentylcyclopropane
CID 56979389
3-ethylpentylcyclopropane
CID 91030831
1-cyclopentyl-4-methylhexan-3-ol
CID 115823411
(2R)-4-cyclopropylbutan-2-amine
CID 95367313
(4R)-3-ethyl-4-methylhexane
CID 59954491
2-butan-2-ylhexylcyclopropane
CID 123731337
1-cyclopropyl-5-methylheptan-3-ol
CID 115810732
4-(4-ethylcyclohexyl)butan-2-ol
CID 64774700
[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane
CID 57296236
1-cyclopropyl-4,5-dimethylhexan-3-ol
CID 115810725
1-cyclopropyl-4,5-dimethylhexan-3-amine
CID 104995209

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-4,5-dimethylheptyl)cyclopropane?
The IUPAC name of (3-ethyl-4,5-dimethylheptyl)cyclopropane (CID 123809704) is (3-ethyl-4,5-dimethylheptyl)cyclopropane.
What is the SMILES notation for (3-ethyl-4,5-dimethylheptyl)cyclopropane?
The canonical SMILES for (3-ethyl-4,5-dimethylheptyl)cyclopropane is CCC(C)C(C)C(CC)CCC1CC1.
What is the InChIKey of (3-ethyl-4,5-dimethylheptyl)cyclopropane?
The InChIKey is OUJVJLAJGBWDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-5-11(3)12(4)14(6-2)10-9-13-7-8-13/h11-14H,5-10H2,1-4H3.
What are the key properties of (3-ethyl-4,5-dimethylheptyl)cyclopropane?
(3-ethyl-4,5-dimethylheptyl)cyclopropane has a molecular weight of 196.38 g/mol, XLogP of 4.89, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-4,5-dimethylheptyl)cyclopropane is sourced from PubChem (CID 123809704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).