(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane

C15H30 — CID 144924130

IUPAC(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane
SMILESC/C=C(\CCCC)C(CC(C)C)C(C)C
InChIInChI=1S/C15H30/c1-7-9-10-14(8-2)15(13(5)6)11-12(3)4/h8,12-13,15H,7,9-11H2,1-6H3/b14-8+
InChIKeyQYAHLVOMPHBXLS-RIYZIHGNSA-N
MW210.40 g/mol
LogP5.44
Rot. Bonds7

About (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane

(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane (PubChem CID 144924130) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane.

Molecular Properties

Compound Name(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane
PubChem CID144924130
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane
SMILESC/C=C(\CCCC)C(CC(C)C)C(C)C
InChIInChI=1S/C15H30/c1-7-9-10-14(8-2)15(13(5)6)11-12(3)4/h8,12-13,15H,7,9-11H2,1-6H3/b14-8+
InChIKeyQYAHLVOMPHBXLS-RIYZIHGNSA-N
XLogP5.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-ethylidene-3-methyloctane
CID 90798217
9-ethyl-5-ethylidene-2,4-dimethyltridecane
CID 123664205
6-ethyl-5-ethylidene-7-propyltridecane
CID 123635810
2,4-dimethylpentane;pentane
CID 161023213
ethyl 2,3-bis(2-methylpropyl)-4-oxooctanoate
CID 142729958
methyl 2,3-bis(2-methylpropyl)-4-oxooctanoate
CID 142730002
(13Z)-13-ethylidene-12-methylheptadecan-1-amine
CID 146337123
6-methyl-N-(2-methyl-5-oxononan-4-yl)-4-oxo-2-propan-2-yl-5-(tritiocarbonylamino)heptanamide
CID 158567206
2,4-dimethylpentane;ethane;heptane
CID 153392396
(4Z)-4-ethylidene-5-methylnonane
CID 142307818
N-(5-methyl-2-oxohexan-3-yl)pentanamide
CID 123525185
4-iodo-2-methyloctane
CID 174582268

Frequently Asked Questions

What is the IUPAC name of (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane?
The IUPAC name of (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane (CID 144924130) is (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane.
What is the SMILES notation for (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane?
The canonical SMILES for (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane is C/C=C(\CCCC)C(CC(C)C)C(C)C.
What is the InChIKey of (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane?
The InChIKey is QYAHLVOMPHBXLS-RIYZIHGNSA-N. The full InChI is InChI=1S/C15H30/c1-7-9-10-14(8-2)15(13(5)6)11-12(3)4/h8,12-13,15H,7,9-11H2,1-6H3/b14-8+.
What are the key properties of (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane?
(5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane has a molecular weight of 210.40 g/mol, XLogP of 5.44, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-ethylidene-2-methyl-4-propan-2-ylnonane is sourced from PubChem (CID 144924130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).