(2R)-2,4-diethylhexanamide

C10H21NO — CID 95562524

IUPAC(2R)-2,4-diethylhexanamide
SMILESCCC(CC)C[C@@H](CC)C(N)=O
InChIInChI=1S/C10H21NO/c1-4-8(5-2)7-9(6-3)10(11)12/h8-9H,4-7H2,1-3H3,(H2,11,12)/t9-/m1/s1
InChIKeyWBCZEXDUVMXLAF-SECBINFHSA-N
MW171.28 g/mol
LogP2.32
Rot. Bonds6

About (2R)-2,4-diethylhexanamide

(2R)-2,4-diethylhexanamide (PubChem CID 95562524) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2R)-2,4-diethylhexanamide.

Molecular Properties

Compound Name(2R)-2,4-diethylhexanamide
PubChem CID95562524
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2R)-2,4-diethylhexanamide
SMILESCCC(CC)C[C@@H](CC)C(N)=O
InChIInChI=1S/C10H21NO/c1-4-8(5-2)7-9(6-3)10(11)12/h8-9H,4-7H2,1-3H3,(H2,11,12)/t9-/m1/s1
InChIKeyWBCZEXDUVMXLAF-SECBINFHSA-N
XLogP2.32
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(aminomethyl)-4-ethylhexanamide
CID 62313240
dodecane-2,4,6,8-tetracarboxamide
CID 89075509
1-methylhenhectane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73,75,77,79,81,83,85,87,89,91,93,95,97,99-pentacontacarboxamide
CID 89449425
4-carbamoyl-2-methylhexanoic acid
CID 20783257
4,6-dicarbamoyl-2-methyloctanoic acid
CID 89382059
(2S,4R)-4-carbamoyl-2-propylhexanoic acid
CID 59815875
4-carbamoylhexane-2-sulfinic acid
CID 58120546
4-acetyl-2-ethyl-6-methyloctanamide
CID 58825488
2-ethylpentanamide;hydrochloride
CID 121334657
ethane;2-ethylpentanamide
CID 178117178
2-ethyl-6,6,6-trifluoro-4-methylhexanamide
CID 20705384
(2S)-2-ethylpentanediamide
CID 146526357

Frequently Asked Questions

What is the IUPAC name of (2R)-2,4-diethylhexanamide?
The IUPAC name of (2R)-2,4-diethylhexanamide (CID 95562524) is (2R)-2,4-diethylhexanamide.
What is the SMILES notation for (2R)-2,4-diethylhexanamide?
The canonical SMILES for (2R)-2,4-diethylhexanamide is CCC(CC)C[C@@H](CC)C(N)=O.
What is the InChIKey of (2R)-2,4-diethylhexanamide?
The InChIKey is WBCZEXDUVMXLAF-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-8(5-2)7-9(6-3)10(11)12/h8-9H,4-7H2,1-3H3,(H2,11,12)/t9-/m1/s1.
What are the key properties of (2R)-2,4-diethylhexanamide?
(2R)-2,4-diethylhexanamide has a molecular weight of 171.28 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,4-diethylhexanamide is sourced from PubChem (CID 95562524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).