(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide

C13H26N2O2 — CID 119343507

IUPAC(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide
SMILESCCOC(CCNC(=O)[C@H](C)N)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-3-17-12(11-6-4-5-7-11)8-9-15-13(16)10(2)14/h10-12H,3-9,14H2,1-2H3,(H,15,16)/t10-,12?/m0/s1
InChIKeyZEENHKOXUZLXNY-NUHJPDEHSA-N
MW242.36 g/mol
LogP1.44
Rot. Bonds7

About (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide

(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide (PubChem CID 119343507) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide
PubChem CID119343507
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide
SMILESCCOC(CCNC(=O)[C@H](C)N)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-3-17-12(11-6-4-5-7-11)8-9-15-13(16)10(2)14/h10-12H,3-9,14H2,1-2H3,(H,15,16)/t10-,12?/m0/s1
InChIKeyZEENHKOXUZLXNY-NUHJPDEHSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride
CID 120502230
2-amino-N-(3-cyclopentyl-3-ethoxypropyl)acetamide;hydrochloride
CID 119343510
1-amino-N-(3-cyclopentyl-3-ethoxypropyl)cyclohexane-1-carboxamide
CID 119343531
1-(3-cyclopentyl-3-ethoxypropyl)-2-propylguanidine
CID 111601024
1-(3-cyclopentyl-3-ethoxypropyl)-2-methyl-3-(2-methylsulfanylethyl)guanidine
CID 111967571
(3S)-3-cyclopentyl-3-ethoxypropan-1-amine
CID 95757314
N-(3-cyclopentyl-3-ethoxypropyl)morpholine-3-carboxamide
CID 119818458
1-(3-cyclopentyl-3-ethoxypropyl)-3-(3-methoxypropyl)-2-methylguanidine
CID 111966637
2-amino-N-(cyclohexylmethyl)propanamide
CID 43215382
2-amino-N-(cyclooctylmethyl)propanamide;hydrochloride
CID 119299452
(2R)-2-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]propanamide
CID 119313821
(2S)-2-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]propanamide
CID 119313801

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide (CID 119343507) is (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide is CCOC(CCNC(=O)[C@H](C)N)C1CCCC1.
What is the InChIKey of (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide?
The InChIKey is ZEENHKOXUZLXNY-NUHJPDEHSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-17-12(11-6-4-5-7-11)8-9-15-13(16)10(2)14/h10-12H,3-9,14H2,1-2H3,(H,15,16)/t10-,12?/m0/s1.
What are the key properties of (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide?
(2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide has a molecular weight of 242.36 g/mol, XLogP of 1.44, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(3-cyclopentyl-3-ethoxypropyl)propanamide is sourced from PubChem (CID 119343507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).