5-ethyl-5-propan-2-yltetradecane

C19H40 — CID 123207557

IUPAC5-ethyl-5-propan-2-yltetradecane
SMILESCCCCCCCCCC(CC)(CCCC)C(C)C
InChIInChI=1S/C19H40/c1-6-9-11-12-13-14-15-17-19(8-3,18(4)5)16-10-7-2/h18H,6-17H2,1-5H3
InChIKeyXVGIBQONAJONND-UHFFFAOYSA-N
MW268.53 g/mol
LogP7.37
Rot. Bonds13

About 5-ethyl-5-propan-2-yltetradecane

5-ethyl-5-propan-2-yltetradecane (PubChem CID 123207557) has the molecular formula C19H40 and a molecular weight of 268.53 g/mol. Its IUPAC name is 5-ethyl-5-propan-2-yltetradecane.

Molecular Properties

Compound Name5-ethyl-5-propan-2-yltetradecane
PubChem CID123207557
Molecular FormulaC19H40
Molecular Weight268.53 g/mol
Exact Mass268.31
IUPAC Name5-ethyl-5-propan-2-yltetradecane
SMILESCCCCCCCCCC(CC)(CCCC)C(C)C
InChIInChI=1S/C19H40/c1-6-9-11-12-13-14-15-17-19(8-3,18(4)5)16-10-7-2/h18H,6-17H2,1-5H3
InChIKeyXVGIBQONAJONND-UHFFFAOYSA-N
XLogP7.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.53
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3,3-diethyl-2-methyldodecane
CID 151072312
2-heptyl-2-propan-2-ylpropane-1,3-diol
CID 79450915
2-hexyl-2-propan-2-ylpropane-1,3-diol
CID 79450743
2-decyl-2-propan-2-ylpropane-1,3-diol
CID 79450466
2,2-diethyloctane-1,1-diol
CID 18324063
2,3,3-trimethyloctadecane
CID 90966938
10,10-di(propan-2-yl)octacosane
CID 152510996
3-ethyl-2,3-dimethylnonane
CID 57490996
3-ethyl-2,3-dimethyldecane
CID 57491701
5-butyl-5-ethylhenicosan-6-amine
CID 87754040
2-(methoxymethyl)-2-propan-2-yldecan-1-amine
CID 139968822
2,3-dimethyl-3-propan-2-yldodecane
CID 150435624

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-propan-2-yltetradecane?
The IUPAC name of 5-ethyl-5-propan-2-yltetradecane (CID 123207557) is 5-ethyl-5-propan-2-yltetradecane.
What is the SMILES notation for 5-ethyl-5-propan-2-yltetradecane?
The canonical SMILES for 5-ethyl-5-propan-2-yltetradecane is CCCCCCCCCC(CC)(CCCC)C(C)C.
What is the InChIKey of 5-ethyl-5-propan-2-yltetradecane?
The InChIKey is XVGIBQONAJONND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40/c1-6-9-11-12-13-14-15-17-19(8-3,18(4)5)16-10-7-2/h18H,6-17H2,1-5H3.
What are the key properties of 5-ethyl-5-propan-2-yltetradecane?
5-ethyl-5-propan-2-yltetradecane has a molecular weight of 268.53 g/mol, XLogP of 7.37, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-propan-2-yltetradecane is sourced from PubChem (CID 123207557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).