3-ethyl-2-methyl-7-propan-2-yldecane

C16H34 — CID 58999360

IUPAC3-ethyl-2-methyl-7-propan-2-yldecane
SMILESCCCC(CCCC(CC)C(C)C)C(C)C
InChIInChI=1S/C16H34/c1-7-10-16(14(5)6)12-9-11-15(8-2)13(3)4/h13-16H,7-12H2,1-6H3
InChIKeyBTZRFRWDZHNPEG-UHFFFAOYSA-N
MW226.45 g/mol
LogP5.91
Rot. Bonds9

About 3-ethyl-2-methyl-7-propan-2-yldecane

3-ethyl-2-methyl-7-propan-2-yldecane (PubChem CID 58999360) has the molecular formula C16H34 and a molecular weight of 226.45 g/mol. Its IUPAC name is 3-ethyl-2-methyl-7-propan-2-yldecane.

Molecular Properties

Compound Name3-ethyl-2-methyl-7-propan-2-yldecane
PubChem CID58999360
Molecular FormulaC16H34
Molecular Weight226.45 g/mol
Exact Mass226.27
IUPAC Name3-ethyl-2-methyl-7-propan-2-yldecane
SMILESCCCC(CCCC(CC)C(C)C)C(C)C
InChIInChI=1S/C16H34/c1-7-10-16(14(5)6)12-9-11-15(8-2)13(3)4/h13-16H,7-12H2,1-6H3
InChIKeyBTZRFRWDZHNPEG-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500226.45
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(3R)-3-ethyl-2-methylhexane
CID 59954424
ethane;(3R)-3-ethyl-2-methylheptane
CID 166461427
5-ethyl-4,9,10-tripropyltridecane
CID 21351361
4-propan-2-yldecane
CID 15038736
4-ethyl-1-iodo-5-methylhexane
CID 118326959
4,5-diethylnonane
CID 21188862
4-ethyl-5-methylhexan-1-ol
CID 87192920
9-ethyl-3,8-dimethyl-4-propyldodecane
CID 142338103
N-methyl-4-propan-2-ylheptan-1-amine
CID 139333212
4,5-diethyloctane
CID 519254
6-propan-2-yltridecane
CID 123704479
4-ethyl-2-methyl-3-propan-2-ylheptane
CID 57491433

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-7-propan-2-yldecane?
The IUPAC name of 3-ethyl-2-methyl-7-propan-2-yldecane (CID 58999360) is 3-ethyl-2-methyl-7-propan-2-yldecane.
What is the SMILES notation for 3-ethyl-2-methyl-7-propan-2-yldecane?
The canonical SMILES for 3-ethyl-2-methyl-7-propan-2-yldecane is CCCC(CCCC(CC)C(C)C)C(C)C.
What is the InChIKey of 3-ethyl-2-methyl-7-propan-2-yldecane?
The InChIKey is BTZRFRWDZHNPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34/c1-7-10-16(14(5)6)12-9-11-15(8-2)13(3)4/h13-16H,7-12H2,1-6H3.
What are the key properties of 3-ethyl-2-methyl-7-propan-2-yldecane?
3-ethyl-2-methyl-7-propan-2-yldecane has a molecular weight of 226.45 g/mol, XLogP of 5.91, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-7-propan-2-yldecane is sourced from PubChem (CID 58999360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).