2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide

C12H24N2O2 — CID 63828819

IUPAC2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NCCOC1CCCC1
InChIInChI=1S/C12H24N2O2/c1-9(2)11(13)12(15)14-7-8-16-10-5-3-4-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyKFBMKLAQOZYFPP-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.05
Rot. Bonds6

About 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide

2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide (PubChem CID 63828819) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide
PubChem CID63828819
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NCCOC1CCCC1
InChIInChI=1S/C12H24N2O2/c1-9(2)11(13)12(15)14-7-8-16-10-5-3-4-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyKFBMKLAQOZYFPP-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.05
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

(2R)-2-amino-N-(2-cycloheptyloxyethyl)propanamide;hydrochloride
CID 119325372
2-amino-N-(2-cyclopentyloxyethyl)-3,3-dimethylbutanamide
CID 77009240
2-amino-N-(2-cyclopentyloxyethyl)pentanamide
CID 63827048
3-amino-N-(2-cyclohexyloxyethyl)butanamide
CID 63828834
(2R)-2-amino-N-(2-cyclopentyloxyethyl)pentanamide
CID 103795665
(2R)-2-amino-N-(2-cyclohexyloxyethyl)pentanamide
CID 98582827
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
(2S)-2-amino-N-(2-cyclopentyloxyethyl)hexanamide
CID 98585845
N-(2-cyclopentyloxyethyl)-3-(ethylamino)-2-methylpropanamide
CID 63828827
(2R)-2-amino-N-(2-cyclohexyloxyethyl)-4-methylsulfanylbutanamide
CID 104908500
(2R)-2-amino-3-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104761131
(2R)-2-amino-N-(2-cyclohexylethyl)-3-methylbutanamide
CID 79012516

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide?
The IUPAC name of 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide (CID 63828819) is 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide?
The canonical SMILES for 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide is CC(C)C(N)C(=O)NCCOC1CCCC1.
What is the InChIKey of 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide?
The InChIKey is KFBMKLAQOZYFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(2)11(13)12(15)14-7-8-16-10-5-3-4-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide?
2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide has a molecular weight of 228.34 g/mol, XLogP of 1.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide is sourced from PubChem (CID 63828819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).