(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide

C13H26N2O2 — CID 98585845

IUPAC(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide
SMILESCCCC[C@H](N)C(=O)NCCOC1CCCC1
InChIInChI=1S/C13H26N2O2/c1-2-3-8-12(14)13(16)15-9-10-17-11-6-4-5-7-11/h11-12H,2-10,14H2,1H3,(H,15,16)/t12-/m0/s1
InChIKeySOTZWCTXNQCSSZ-LBPRGKRZSA-N
MW242.36 g/mol
LogP1.58
Rot. Bonds8

About (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide

(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide (PubChem CID 98585845) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide
PubChem CID98585845
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide
SMILESCCCC[C@H](N)C(=O)NCCOC1CCCC1
InChIInChI=1S/C13H26N2O2/c1-2-3-8-12(14)13(16)15-9-10-17-11-6-4-5-7-11/h11-12H,2-10,14H2,1H3,(H,15,16)/t12-/m0/s1
InChIKeySOTZWCTXNQCSSZ-LBPRGKRZSA-N
XLogP1.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-cyclopentyloxyethyl)pentanamide
CID 63827048
(2R)-2-amino-N-(2-cyclopentyloxyethyl)pentanamide
CID 103795665
(2R)-2-amino-N-(2-cyclohexyloxyethyl)pentanamide
CID 98582827
(2R)-2-amino-N-(2-cyclohexyloxyethyl)-4-methylsulfanylbutanamide
CID 104908500
2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide
CID 63828819
(2R)-2-amino-N-(2-cycloheptyloxyethyl)propanamide;hydrochloride
CID 119325372
2-amino-N-(2-cyclopentyloxyethyl)-3,3-dimethylbutanamide
CID 77009240
2-amino-N-hexylhexanamide
CID 60852762
N-butyl-2-(2-cyclopentyloxyethylamino)propanamide
CID 55261648
(2S)-2-amino-N-(2-cyclopropylethyl)hexanamide
CID 103831775
2-carbamothioyl-N-(2-cyclohexyloxyethyl)pentanamide
CID 55259925
3-amino-N-(2-cyclohexyloxyethyl)butanamide
CID 63828834

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide?
The IUPAC name of (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide (CID 98585845) is (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide?
The canonical SMILES for (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide is CCCC[C@H](N)C(=O)NCCOC1CCCC1.
What is the InChIKey of (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide?
The InChIKey is SOTZWCTXNQCSSZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-3-8-12(14)13(16)15-9-10-17-11-6-4-5-7-11/h11-12H,2-10,14H2,1H3,(H,15,16)/t12-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide?
(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide has a molecular weight of 242.36 g/mol, XLogP of 1.58, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide is sourced from PubChem (CID 98585845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).