5-amino-N-(4-hydroxybutyl)-4-methylpentanamide

C10H22N2O2 — CID 106842029

IUPAC5-amino-N-(4-hydroxybutyl)-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCCCCO
InChIInChI=1S/C10H22N2O2/c1-9(8-11)4-5-10(14)12-6-2-3-7-13/h9,13H,2-8,11H2,1H3,(H,12,14)
InChIKeyDTJPSEYGBNUSNR-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds8

About 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide

5-amino-N-(4-hydroxybutyl)-4-methylpentanamide (PubChem CID 106842029) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-(4-hydroxybutyl)-4-methylpentanamide
PubChem CID106842029
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name5-amino-N-(4-hydroxybutyl)-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCCCCO
InChIInChI=1S/C10H22N2O2/c1-9(8-11)4-5-10(14)12-6-2-3-7-13/h9,13H,2-8,11H2,1H3,(H,12,14)
InChIKeyDTJPSEYGBNUSNR-UHFFFAOYSA-N
XLogP0.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.25
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

5-[(5-amino-4-methylpentanoyl)amino]pentanoic acid
CID 82689538
5-amino-N-[3-(2-hydroxyethoxy)propyl]-4-methylpentanamide
CID 106310722
5-amino-N-(3-cyanopropyl)-4-methylpentanamide
CID 82010988
5-amino-4-methyl-N-[4-[methyl(propan-2-yl)amino]butyl]pentanamide
CID 82011389
5-amino-4-methyl-N-[2-(2-methylpropanoylamino)ethyl]pentanamide
CID 82012399
5-amino-N-(5-hydroxypentyl)hexanamide
CID 107317733
N-(5-amino-4-methylpentyl)hexanamide
CID 57163193
2-[(5-amino-4-methylpentanoyl)amino]ethyl carbamate
CID 83210908
5-amino-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpentanamide
CID 82683387
ethyl 3-[(5-amino-4-methylpentanoyl)amino]propanoate
CID 82011532
4-hydroxy-N-[4-(4-hydroxybutanoylamino)butyl]butanamide
CID 6611551
N-(4-hydroxybutyl)-4-oxopentanamide
CID 58331315

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide?
The IUPAC name of 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide (CID 106842029) is 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide?
The canonical SMILES for 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide is CC(CN)CCC(=O)NCCCCO.
What is the InChIKey of 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide?
The InChIKey is DTJPSEYGBNUSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-9(8-11)4-5-10(14)12-6-2-3-7-13/h9,13H,2-8,11H2,1H3,(H,12,14).
What are the key properties of 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide?
5-amino-N-(4-hydroxybutyl)-4-methylpentanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(4-hydroxybutyl)-4-methylpentanamide is sourced from PubChem (CID 106842029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).