2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide

C11H24N2O2 — CID 43416442

IUPAC2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NCCCO
InChIInChI=1S/C11H24N2O2/c1-5-11(3,4)13-10(15)9(2)12-7-6-8-14/h9,12,14H,5-8H2,1-4H3,(H,13,15)
InChIKeyYLIXGHOQMRBFFJ-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.65
Rot. Bonds7

About 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide

2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide (PubChem CID 43416442) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
PubChem CID43416442
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NCCCO
InChIInChI=1S/C11H24N2O2/c1-5-11(3,4)13-10(15)9(2)12-7-6-8-14/h9,12,14H,5-8H2,1-4H3,(H,13,15)
InChIKeyYLIXGHOQMRBFFJ-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.65
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

N-(2-methylbutan-2-yl)-2-(pentylamino)propanamide
CID 43112752
2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 60720233
N-(2-methylbutan-2-yl)-2-(3-methylbutylamino)propanamide
CID 43112990
2-(ethylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43112409
2-[2-(dimethylamino)ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 43112399
N-(2-methylbutan-2-yl)-2-(3,3,3-trifluoropropylamino)propanamide
CID 55173400
2-(2-butoxyethylamino)-N-(2-methylbutan-2-yl)propanamide
CID 61170101
N-(2-methylbutan-2-yl)-2-(3-phenylpropylamino)propanamide
CID 60720415
N-ethyl-2-(3-hydroxypropylamino)propanamide
CID 43392791
N-(2-methylbutan-2-yl)-2-(2-methylbutan-2-ylamino)propanamide
CID 43116529
2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
CID 83176935
N-(2-methylbutan-2-yl)-2-(3-methylbut-2-enylamino)propanamide
CID 103520478

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide (CID 43416442) is 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)NCCCO.
What is the InChIKey of 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is YLIXGHOQMRBFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-11(3,4)13-10(15)9(2)12-7-6-8-14/h9,12,14H,5-8H2,1-4H3,(H,13,15).
What are the key properties of 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide?
2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.65, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 43416442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).