(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide

C13H26N2O2 — CID 113353384

IUPAC(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)[C@@H](N)C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-13(2,3)11(14)12(17)15(8-9-16)10-6-4-5-7-10/h10-11,16H,4-9,14H2,1-3H3/t11-/m0/s1
InChIKeyTYVDHYTZRGQGNN-NSHDSACASA-N
MW242.36 g/mol
LogP1.12
Rot. Bonds4

About (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide

(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide (PubChem CID 113353384) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
PubChem CID113353384
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)[C@@H](N)C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-13(2,3)11(14)12(17)15(8-9-16)10-6-4-5-7-10/h10-11,16H,4-9,14H2,1-3H3/t11-/m0/s1
InChIKeyTYVDHYTZRGQGNN-NSHDSACASA-N
XLogP1.12
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-hydroxyethyl)-3,3-dimethyl-N-(1-methylpiperidin-4-yl)butanamide
CID 76894916
2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 60952653
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 102861908
2-amino-N-(cyanomethyl)-N-cyclobutyl-3,3-dimethylbutanamide
CID 23595876
2-amino-N-cyclopentyl-N,3,3-trimethylbutanamide
CID 76893337
2-chloro-N-cyclohexyl-N-(2-hydroxyethyl)propanamide
CID 60949797
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)-2-methylpropanamide
CID 102862067
N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)-2-(trifluoromethyl)propanamide
CID 103310161
3-amino-N-cyclopentyl-N-(2-hydroxyethyl)-2-methoxypropanamide
CID 106112194
4-amino-5-[cyclopentyl(2-hydroxyethyl)amino]-5-oxopentanoic acid
CID 64890682
2-(aminomethyl)-N-cyclobutyl-N-(2-hydroxyethyl)butanamide
CID 102861278
2-acetamido-N-cyclopentyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 54994313

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The IUPAC name of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide (CID 113353384) is (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The canonical SMILES for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide is CC(C)(C)[C@@H](N)C(=O)N(CCO)C1CCCC1.
What is the InChIKey of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The InChIKey is TYVDHYTZRGQGNN-NSHDSACASA-N. The full InChI is InChI=1S/C13H26N2O2/c1-13(2,3)11(14)12(17)15(8-9-16)10-6-4-5-7-10/h10-11,16H,4-9,14H2,1-3H3/t11-/m0/s1.
What are the key properties of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide has a molecular weight of 242.36 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 113353384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).