5-amino-2-(5-hydroxypentanoylamino)pentanamide

C10H21N3O3 — CID 89075373

IUPAC5-amino-2-(5-hydroxypentanoylamino)pentanamide
SMILESNCCCC(NC(=O)CCCCO)C(N)=O
InChIInChI=1S/C10H21N3O3/c11-6-3-4-8(10(12)16)13-9(15)5-1-2-7-14/h8,14H,1-7,11H2,(H2,12,16)(H,13,15)
InChIKeyGKGZMDHUSPCQRF-UHFFFAOYSA-N
MW231.30 g/mol
LogP-1.14
Rot. Bonds9

About 5-amino-2-(5-hydroxypentanoylamino)pentanamide

5-amino-2-(5-hydroxypentanoylamino)pentanamide (PubChem CID 89075373) has the molecular formula C10H21N3O3 and a molecular weight of 231.30 g/mol. Its IUPAC name is 5-amino-2-(5-hydroxypentanoylamino)pentanamide.

Molecular Properties

Compound Name5-amino-2-(5-hydroxypentanoylamino)pentanamide
PubChem CID89075373
Molecular FormulaC10H21N3O3
Molecular Weight231.30 g/mol
Exact Mass231.16
IUPAC Name5-amino-2-(5-hydroxypentanoylamino)pentanamide
SMILESNCCCC(NC(=O)CCCCO)C(N)=O
InChIInChI=1S/C10H21N3O3/c11-6-3-4-8(10(12)16)13-9(15)5-1-2-7-14/h8,14H,1-7,11H2,(H2,12,16)(H,13,15)
InChIKeyGKGZMDHUSPCQRF-UHFFFAOYSA-N
XLogP-1.14
TPSA118.44 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 5-1.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(5-hydroxypentanoylamino)pentanamide?
The IUPAC name of 5-amino-2-(5-hydroxypentanoylamino)pentanamide (CID 89075373) is 5-amino-2-(5-hydroxypentanoylamino)pentanamide.
What is the SMILES notation for 5-amino-2-(5-hydroxypentanoylamino)pentanamide?
The canonical SMILES for 5-amino-2-(5-hydroxypentanoylamino)pentanamide is NCCCC(NC(=O)CCCCO)C(N)=O.
What is the InChIKey of 5-amino-2-(5-hydroxypentanoylamino)pentanamide?
The InChIKey is GKGZMDHUSPCQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3/c11-6-3-4-8(10(12)16)13-9(15)5-1-2-7-14/h8,14H,1-7,11H2,(H2,12,16)(H,13,15).
What are the key properties of 5-amino-2-(5-hydroxypentanoylamino)pentanamide?
5-amino-2-(5-hydroxypentanoylamino)pentanamide has a molecular weight of 231.30 g/mol, XLogP of -1.14, 9 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(5-hydroxypentanoylamino)pentanamide is sourced from PubChem (CID 89075373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).