(2R)-2-amino-N-hex-5-ynylpentanamide

C11H20N2O — CID 106213082

IUPAC(2R)-2-amino-N-hex-5-ynylpentanamide
SMILESC#CCCCCNC(=O)[C@H](N)CCC
InChIInChI=1S/C11H20N2O/c1-3-5-6-7-9-13-11(14)10(12)8-4-2/h1,10H,4-9,12H2,2H3,(H,13,14)/t10-/m1/s1
InChIKeyWOFYTSXLAMKKSF-SNVBAGLBSA-N
MW196.29 g/mol
LogP1.03
Rot. Bonds7

About (2R)-2-amino-N-hex-5-ynylpentanamide

(2R)-2-amino-N-hex-5-ynylpentanamide (PubChem CID 106213082) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is (2R)-2-amino-N-hex-5-ynylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-hex-5-ynylpentanamide
PubChem CID106213082
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name(2R)-2-amino-N-hex-5-ynylpentanamide
SMILESC#CCCCCNC(=O)[C@H](N)CCC
InChIInChI=1S/C11H20N2O/c1-3-5-6-7-9-13-11(14)10(12)8-4-2/h1,10H,4-9,12H2,2H3,(H,13,14)/t10-/m1/s1
InChIKeyWOFYTSXLAMKKSF-SNVBAGLBSA-N
XLogP1.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-hex-5-ynylbutanamide
CID 103950447
(2R)-2-amino-N-butylpentanamide
CID 82668431
(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
CID 106235890
(2S)-2-amino-N-(5-hydroxypentyl)pentanamide
CID 107571012
2-amino-N-(5-methylhexyl)pentanamide
CID 81433782
2-amino-N-propylpentanamide
CID 43649977
7-[[(2R)-2-aminopentanoyl]amino]heptanoic acid
CID 103869350
(2R)-2-amino-N-hex-5-ynyl-3,3-dimethylbutanamide
CID 106213078
6-[[(2R)-2-aminopentanoyl]amino]hexanoic acid
CID 103868717
2-amino-N-hexylhexanamide
CID 60852762
2-amino-3-cyclohexyl-N-hex-5-ynylpropanamide
CID 114264857
(2S)-2-amino-N-(2-hydroxyethyl)pentanamide
CID 89064333

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-hex-5-ynylpentanamide?
The IUPAC name of (2R)-2-amino-N-hex-5-ynylpentanamide (CID 106213082) is (2R)-2-amino-N-hex-5-ynylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-hex-5-ynylpentanamide?
The canonical SMILES for (2R)-2-amino-N-hex-5-ynylpentanamide is C#CCCCCNC(=O)[C@H](N)CCC.
What is the InChIKey of (2R)-2-amino-N-hex-5-ynylpentanamide?
The InChIKey is WOFYTSXLAMKKSF-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-5-6-7-9-13-11(14)10(12)8-4-2/h1,10H,4-9,12H2,2H3,(H,13,14)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-hex-5-ynylpentanamide?
(2R)-2-amino-N-hex-5-ynylpentanamide has a molecular weight of 196.29 g/mol, XLogP of 1.03, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-hex-5-ynylpentanamide is sourced from PubChem (CID 106213082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).