methane;propan-2-ylcyclotetradecane

C18H38 — CID 159882779

IUPACmethane;propan-2-ylcyclotetradecane
SMILESC.CC(C)C1CCCCCCCCCCCCC1
InChIInChI=1S/C17H34.CH4/c1-16(2)17-14-12-10-8-6-4-3-5-7-9-11-13-15-17;/h16-17H,3-15H2,1-2H3;1H4
InChIKeyNTSVOGBPCHKWNL-UHFFFAOYSA-N
MW254.50 g/mol
LogP6.98
Rot. Bonds1

About methane;propan-2-ylcyclotetradecane

methane;propan-2-ylcyclotetradecane (PubChem CID 159882779) has the molecular formula C18H38 and a molecular weight of 254.50 g/mol. Its IUPAC name is methane;propan-2-ylcyclotetradecane.

Molecular Properties

Compound Namemethane;propan-2-ylcyclotetradecane
PubChem CID159882779
Molecular FormulaC18H38
Molecular Weight254.50 g/mol
Exact Mass254.30
IUPAC Namemethane;propan-2-ylcyclotetradecane
SMILESC.CC(C)C1CCCCCCCCCCCCC1
InChIInChI=1S/C17H34.CH4/c1-16(2)17-14-12-10-8-6-4-3-5-7-9-11-13-15-17;/h16-17H,3-15H2,1-2H3;1H4
InChIKeyNTSVOGBPCHKWNL-UHFFFAOYSA-N
XLogP6.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.50
LogP ≤ 56.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1-chloro-3-propan-2-ylcyclononane
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N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
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Frequently Asked Questions

What is the IUPAC name of methane;propan-2-ylcyclotetradecane?
The IUPAC name of methane;propan-2-ylcyclotetradecane (CID 159882779) is methane;propan-2-ylcyclotetradecane.
What is the SMILES notation for methane;propan-2-ylcyclotetradecane?
The canonical SMILES for methane;propan-2-ylcyclotetradecane is C.CC(C)C1CCCCCCCCCCCCC1.
What is the InChIKey of methane;propan-2-ylcyclotetradecane?
The InChIKey is NTSVOGBPCHKWNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34.CH4/c1-16(2)17-14-12-10-8-6-4-3-5-7-9-11-13-15-17;/h16-17H,3-15H2,1-2H3;1H4.
What are the key properties of methane;propan-2-ylcyclotetradecane?
methane;propan-2-ylcyclotetradecane has a molecular weight of 254.50 g/mol, XLogP of 6.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;propan-2-ylcyclotetradecane is sourced from PubChem (CID 159882779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).