propylcyclotetradecane

C17H34 — CID 90991550

IUPACpropylcyclotetradecane
SMILESCCCC1CCCCCCCCCCCCC1
InChIInChI=1S/C17H34/c1-2-14-17-15-12-10-8-6-4-3-5-7-9-11-13-16-17/h17H,2-16H2,1H3
InChIKeyBTPWPOHNIQAHQX-UHFFFAOYSA-N
MW238.46 g/mol
LogP6.49
Rot. Bonds2

About propylcyclotetradecane

propylcyclotetradecane (PubChem CID 90991550) has the molecular formula C17H34 and a molecular weight of 238.46 g/mol. Its IUPAC name is propylcyclotetradecane.

Molecular Properties

Compound Namepropylcyclotetradecane
PubChem CID90991550
Molecular FormulaC17H34
Molecular Weight238.46 g/mol
Exact Mass238.27
IUPAC Namepropylcyclotetradecane
SMILESCCCC1CCCCCCCCCCCCC1
InChIInChI=1S/C17H34/c1-2-14-17-15-12-10-8-6-4-3-5-7-9-11-13-16-17/h17H,2-16H2,1H3
InChIKeyBTPWPOHNIQAHQX-UHFFFAOYSA-N
XLogP6.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.46
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254
1-cyclohexyl-6-propylcyclodecane
CID 58552139
formaldehyde;propylcyclohexane
CID 174845889
formonitrile;propylcyclohexane
CID 174902049
1-butyl-4-propylcyclononane
CID 123467552
1-methyl-5-propylcyclononane
CID 54361658
hydrazine;propylcyclobutane;hydrochloride
CID 18995287
1,1-dimethyl-4-propylcyclotridecane
CID 123608299
tetradecylcycloundecane
CID 169026040
docosylcyclohexane
CID 521991
1-methyl-4-propylcycloheptane
CID 90967653
tetradecylcyclododecane
CID 169026037

Frequently Asked Questions

What is the IUPAC name of propylcyclotetradecane?
The IUPAC name of propylcyclotetradecane (CID 90991550) is propylcyclotetradecane.
What is the SMILES notation for propylcyclotetradecane?
The canonical SMILES for propylcyclotetradecane is CCCC1CCCCCCCCCCCCC1.
What is the InChIKey of propylcyclotetradecane?
The InChIKey is BTPWPOHNIQAHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34/c1-2-14-17-15-12-10-8-6-4-3-5-7-9-11-13-16-17/h17H,2-16H2,1H3.
What are the key properties of propylcyclotetradecane?
propylcyclotetradecane has a molecular weight of 238.46 g/mol, XLogP of 6.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for propylcyclotetradecane is sourced from PubChem (CID 90991550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).