2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide

C11H22N2O3 — CID 103658528

IUPAC2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)CNC(C)=O
InChIInChI=1S/C11H22N2O3/c1-4-9(5-2)10(15)6-13-11(16)7-12-8(3)14/h9-10,15H,4-7H2,1-3H3,(H,12,14)(H,13,16)
InChIKeyKMUBDMMESYGJAI-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.04
Rot. Bonds7

About 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide

2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide (PubChem CID 103658528) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide
PubChem CID103658528
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)CNC(C)=O
InChIInChI=1S/C11H22N2O3/c1-4-9(5-2)10(15)6-13-11(16)7-12-8(3)14/h9-10,15H,4-7H2,1-3H3,(H,12,14)(H,13,16)
InChIKeyKMUBDMMESYGJAI-UHFFFAOYSA-N
XLogP0.04
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
CID 103726360
N-ethyl-2-[(3-ethyl-2-hydroxypentyl)amino]acetamide
CID 106285867
2-chloro-N-[2-[[(2S)-3-ethyl-2-hydroxypentyl]amino]-2-oxoethyl]benzamide
CID 95622425
3-[[(2-acetamidoacetyl)amino]methyl]pentanoic acid
CID 81065753
N-(3-ethyl-2-hydroxypentyl)-5-hydroxypentanamide
CID 106288862
4-amino-N-(3-ethyl-2-hydroxypentyl)pentanamide;hydrochloride
CID 120562635
N-[2,3-dihydroxy-4-(hydroxymethyl)hexyl]acetamide
CID 123622831
N-(3-ethyl-2-hydroxypentyl)-3-methylbut-2-enamide
CID 103770596
3-(ethylamino)-N-(3-ethyl-2-hydroxypentyl)butanamide
CID 114168522
4-ethoxy-N-(3-ethyl-2-hydroxypentyl)butanamide
CID 113234511
4-[(3-ethyl-2-hydroxypentyl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 114168261
1-(3-ethyl-2-hydroxypentyl)-3-propylurea
CID 103657880

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide?
The IUPAC name of 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide (CID 103658528) is 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide.
What is the SMILES notation for 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide?
The canonical SMILES for 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide is CCC(CC)C(O)CNC(=O)CNC(C)=O.
What is the InChIKey of 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide?
The InChIKey is KMUBDMMESYGJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-4-9(5-2)10(15)6-13-11(16)7-12-8(3)14/h9-10,15H,4-7H2,1-3H3,(H,12,14)(H,13,16).
What are the key properties of 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide?
2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide has a molecular weight of 230.31 g/mol, XLogP of 0.04, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(3-ethyl-2-hydroxypentyl)acetamide is sourced from PubChem (CID 103658528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).