N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide

C10H22N2O2 — CID 120506511

IUPACN-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide
SMILESCCCCCOCC(=O)N[C@@H](C)CN
InChIInChI=1S/C10H22N2O2/c1-3-4-5-6-14-8-10(13)12-9(2)7-11/h9H,3-8,11H2,1-2H3,(H,12,13)/t9-/m0/s1
InChIKeyUDXMCIYOCRLYEV-VIFPVBQESA-N
MW202.30 g/mol
LogP0.66
Rot. Bonds8

About N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide

N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide (PubChem CID 120506511) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide.

Molecular Properties

Compound NameN-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide
PubChem CID120506511
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide
SMILESCCCCCOCC(=O)N[C@@H](C)CN
InChIInChI=1S/C10H22N2O2/c1-3-4-5-6-14-8-10(13)12-9(2)7-11/h9H,3-8,11H2,1-2H3,(H,12,13)/t9-/m0/s1
InChIKeyUDXMCIYOCRLYEV-VIFPVBQESA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.66
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-decoxy-N-(1-hydroxyethyl)acetamide
CID 88812152
N-(2-amino-1-cyclopropylethyl)-2-pentoxyacetamide
CID 119613092
N-[(2R)-1-aminopropan-2-yl]nonanamide
CID 104873041
N-[(2R)-1-aminopropan-2-yl]-4-ethoxybutanamide
CID 104872961
N-(2-amino-1-cyclohexylethyl)-2-pentoxyacetamide;hydrochloride
CID 119589204
N-(1-amino-2,3-dimethylbutan-2-yl)-2-pentoxyacetamide;hydrochloride
CID 119605723
2-tridecoxyacetamide
CID 54483018
3-[(2-propoxyacetyl)amino]butanamide
CID 103711750
2-(2-methoxyethoxy)-N-pentan-2-ylacetamide
CID 103601639
2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]acetamide
CID 171838427
2-decoxy-N-sulfanylacetamide
CID 150404301
2-[(2-butoxyacetyl)amino]-3-methylpentanoic acid
CID 119211767

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide?
The IUPAC name of N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide (CID 120506511) is N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide.
What is the SMILES notation for N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide?
The canonical SMILES for N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide is CCCCCOCC(=O)N[C@@H](C)CN.
What is the InChIKey of N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide?
The InChIKey is UDXMCIYOCRLYEV-VIFPVBQESA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-4-5-6-14-8-10(13)12-9(2)7-11/h9H,3-8,11H2,1-2H3,(H,12,13)/t9-/m0/s1.
What are the key properties of N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide?
N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide has a molecular weight of 202.30 g/mol, XLogP of 0.66, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-aminopropan-2-yl]-2-pentoxyacetamide is sourced from PubChem (CID 120506511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).