2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide

C12H26N2O3 — CID 81088565

IUPAC2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide
SMILESCCOCCN(CC)C(=O)C(N)CCCOC
InChIInChI=1S/C12H26N2O3/c1-4-14(8-10-17-5-2)12(15)11(13)7-6-9-16-3/h11H,4-10,13H2,1-3H3
InChIKeyOQZMLWOJLUWKCF-UHFFFAOYSA-N
MW246.35 g/mol
LogP0.63
Rot. Bonds10

About 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide

2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide (PubChem CID 81088565) has the molecular formula C12H26N2O3 and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide
PubChem CID81088565
Molecular FormulaC12H26N2O3
Molecular Weight246.35 g/mol
Exact Mass246.19
IUPAC Name2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide
SMILESCCOCCN(CC)C(=O)C(N)CCCOC
InChIInChI=1S/C12H26N2O3/c1-4-14(8-10-17-5-2)12(15)11(13)7-6-9-16-3/h11H,4-10,13H2,1-3H3
InChIKeyOQZMLWOJLUWKCF-UHFFFAOYSA-N
XLogP0.63
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-ethoxyethyl)-N-ethylhexanamide
CID 63692347
(2S)-2-amino-N-(2-ethoxyethyl)-N-ethylhexanamide
CID 103831646
2-amino-N-ethyl-N-(2-hydroxyethyl)-5-methoxypentanamide
CID 81082966
(2S)-2-amino-N-(2-ethoxyethyl)-N-ethylpentanamide
CID 107569737
2-amino-N-(2-ethoxyethyl)-N-ethyl-4-methylsulfonylbutanamide
CID 63690929
2-[(2-amino-5-methoxypentanoyl)-ethylamino]acetic acid
CID 81088213
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-3-methylbutanamide
CID 79013546
2-amino-5-methoxy-N-(3-methoxypropyl)-N-methylpentanamide
CID 81088448
(2S,3S)-2-amino-N-(2-ethoxyethyl)-N-ethyl-3-methylpentanamide
CID 63690931
2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide
CID 81081261
2-amino-N-(3-ethoxypropyl)-4-methoxy-N-(2,2,2-trifluoroethyl)butanamide
CID 62474145
2-amino-5-methoxy-N-methyl-N-pentylpentanamide
CID 81082325

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide?
The IUPAC name of 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide (CID 81088565) is 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide is CCOCCN(CC)C(=O)C(N)CCCOC.
What is the InChIKey of 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide?
The InChIKey is OQZMLWOJLUWKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3/c1-4-14(8-10-17-5-2)12(15)11(13)7-6-9-16-3/h11H,4-10,13H2,1-3H3.
What are the key properties of 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide?
2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide has a molecular weight of 246.35 g/mol, XLogP of 0.63, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methoxypentanamide is sourced from PubChem (CID 81088565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).