(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide

C10H21N3O2 — CID 106235890

IUPAC(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
SMILESCCC[C@H](N)C(=O)NCCCCC(N)=O
InChIInChI=1S/C10H21N3O2/c1-2-5-8(11)10(15)13-7-4-3-6-9(12)14/h8H,2-7,11H2,1H3,(H2,12,14)(H,13,15)/t8-/m0/s1
InChIKeyAZXSCABZHKKBDB-QMMMGPOBSA-N
MW215.30 g/mol
LogP-0.11
Rot. Bonds8

About (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide

(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide (PubChem CID 106235890) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
PubChem CID106235890
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
SMILESCCC[C@H](N)C(=O)NCCCCC(N)=O
InChIInChI=1S/C10H21N3O2/c1-2-5-8(11)10(15)13-7-4-3-6-9(12)14/h8H,2-7,11H2,1H3,(H2,12,14)(H,13,15)/t8-/m0/s1
InChIKeyAZXSCABZHKKBDB-QMMMGPOBSA-N
XLogP-0.11
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.11
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-[[(2R)-2-aminopentanoyl]amino]heptanoic acid
CID 103869350
6-[[(2R)-2-aminopentanoyl]amino]hexanoic acid
CID 103868717
(2R)-2-amino-N-butylpentanamide
CID 82668431
(2S)-2-amino-N-(5-hydroxypentyl)pentanamide
CID 107571012
2-amino-N-(5-methylhexyl)pentanamide
CID 81433782
2-amino-N-propylpentanamide
CID 43649977
2-amino-N-(5-amino-5-oxopentyl)-4-methylpentanamide
CID 106235612
4-amino-5-[(4-amino-4-oxobutyl)amino]-5-oxopentanoic acid
CID 64890076
2-amino-N-octadecyl-5-oxotetracosanamide
CID 161320557
(2R)-2-amino-N-hex-5-ynylpentanamide
CID 106213082
(2S)-2-amino-6-[(2,5-diamino-5-oxopentanoyl)amino]hexanoic acid
CID 174585198
2-amino-N-hexylhexanamide
CID 60852762

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide?
The IUPAC name of (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide (CID 106235890) is (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide is CCC[C@H](N)C(=O)NCCCCC(N)=O.
What is the InChIKey of (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide?
The InChIKey is AZXSCABZHKKBDB-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-2-5-8(11)10(15)13-7-4-3-6-9(12)14/h8H,2-7,11H2,1H3,(H2,12,14)(H,13,15)/t8-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide?
(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide has a molecular weight of 215.30 g/mol, XLogP of -0.11, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide is sourced from PubChem (CID 106235890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).