5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide

C10H22N2O2 — CID 66090702

IUPAC5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide
SMILESCC(CCO)CNC(=O)CCCCN
InChIInChI=1S/C10H22N2O2/c1-9(5-7-13)8-12-10(14)4-2-3-6-11/h9,13H,2-8,11H2,1H3,(H,12,14)
InChIKeyPSTSSEHIMTUQJV-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds8

About 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide

5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide (PubChem CID 66090702) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide.

Molecular Properties

Compound Name5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide
PubChem CID66090702
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide
SMILESCC(CCO)CNC(=O)CCCCN
InChIInChI=1S/C10H22N2O2/c1-9(5-7-13)8-12-10(14)4-2-3-6-11/h9,13H,2-8,11H2,1H3,(H,12,14)
InChIKeyPSTSSEHIMTUQJV-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

7-amino-N-(2-methylbutyl)heptanamide
CID 62693522
2-amino-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089038
6-amino-N-(2-methylpropyl)hexanamide
CID 24696940
5-amino-N-(4-hydroxybutan-2-yl)pentanamide
CID 83177679
7-amino-N-(2,3-dimethylbutyl)heptanamide;hydrochloride
CID 119796493
N-(4-hydroxy-2-methylbutyl)-3-methylsulfonylpropanamide
CID 66107104
N-(2-methylpentyl)hexanamide
CID 173325003
3-(2-amino-2-oxoethyl)sulfanyl-N-(4-hydroxy-2-methylbutyl)propanamide
CID 66107561
7-amino-N-(2-methyl-3-pyrrolidin-1-ylpropyl)heptanamide
CID 62060956
2-chloro-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089686
N-(4-chloro-2-methylbutyl)nonanamide
CID 114306121
2-[(6-aminohexanoylamino)methyl]-3-methylbutanoic acid
CID 65224486

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide?
The IUPAC name of 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide (CID 66090702) is 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide.
What is the SMILES notation for 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide?
The canonical SMILES for 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide is CC(CCO)CNC(=O)CCCCN.
What is the InChIKey of 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide?
The InChIKey is PSTSSEHIMTUQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-9(5-7-13)8-12-10(14)4-2-3-6-11/h9,13H,2-8,11H2,1H3,(H,12,14).
What are the key properties of 5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide?
5-amino-N-(4-hydroxy-2-methylbutyl)pentanamide 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-hydroxy-2-methylbutyl)pentanamide is sourced from PubChem (CID 66090702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).