2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide

C11H24N2O2 — CID 106841692

IUPAC2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CNCCCCO
InChIInChI=1S/C11H24N2O2/c1-9(2)10(3)13-11(15)8-12-6-4-5-7-14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyFOEHYDVJCYSBIH-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.51
Rot. Bonds8

About 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide

2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide (PubChem CID 106841692) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide
PubChem CID106841692
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CNCCCCO
InChIInChI=1S/C11H24N2O2/c1-9(2)10(3)13-11(15)8-12-6-4-5-7-14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyFOEHYDVJCYSBIH-UHFFFAOYSA-N
XLogP0.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(carbamoylamino)ethylamino]-N-(3-methylbutan-2-yl)acetamide
CID 83113955
N-methyl-2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 60695644
2-(2-ethoxyethylamino)-N-(3-methylbutan-2-yl)acetamide
CID 61489218
2-(2,3-dihydroxypropylamino)-N-(3-methylbutan-2-yl)acetamide
CID 66171224
methyl 2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetate
CID 60687550
2-hydroxy-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 172508602
N-(3-methylbutan-2-yl)-2-[3-(triazol-1-yl)propylamino]acetamide
CID 113412705
2-(3-hydroxypropylamino)-N-(2-methylpropyl)acetamide
CID 43389745
N-(3-methylbutan-2-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 60687185
2-(7-methyloctylamino)-N-propan-2-ylacetamide
CID 103604939
2-(4-hydroxybutylamino)acetic acid
CID 22121765
2-(2-imidazol-1-ylethylamino)-N-(3-methylbutan-2-yl)acetamide
CID 60695215

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide (CID 106841692) is 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide is CC(C)C(C)NC(=O)CNCCCCO.
What is the InChIKey of 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is FOEHYDVJCYSBIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)10(3)13-11(15)8-12-6-4-5-7-14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15).
What are the key properties of 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide?
2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 216.32 g/mol, XLogP of 0.51, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxybutylamino)-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 106841692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).