N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide

C10H20N2O3 — CID 115590611

IUPACN-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
SMILESCCCC(=O)NCCC(=O)NCCOC
InChIInChI=1S/C10H20N2O3/c1-3-4-9(13)11-6-5-10(14)12-7-8-15-2/h3-8H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyCJBOPGUKAKGYTL-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.06
Rot. Bonds8

About N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide

N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide (PubChem CID 115590611) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
PubChem CID115590611
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
SMILESCCCC(=O)NCCC(=O)NCCOC
InChIInChI=1S/C10H20N2O3/c1-3-4-9(13)11-6-5-10(14)12-7-8-15-2/h3-8H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyCJBOPGUKAKGYTL-UHFFFAOYSA-N
XLogP0.06
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.06
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

N-(2-methoxyethyl)-3-(3-sulfanylpropanoylamino)propanamide
CID 107034705
N-(2-methoxyethyl)-3-(methylamino)propanamide
CID 43827811
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
CID 113226661
2-methoxy-N-[3-(2-methoxyethylamino)-3-oxopropyl]propanamide
CID 112686354
3-(heptan-4-ylamino)-N-(2-methoxyethyl)propanamide
CID 115676517
5-methoxy-N-(2-methoxyethyl)pentanamide
CID 58281484
2-cyano-N-[3-(2-methoxyethylamino)-3-oxopropyl]pentanamide
CID 113410594
N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pentanamide
CID 134259653
2-amino-N-[3-(2-methoxyethylamino)-3-oxopropyl]-3-methylbutanamide
CID 112700885
N-(2-methoxyethyl)-4-(methylamino)butanamide
CID 60841118

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide?
The IUPAC name of N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide (CID 115590611) is N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide.
What is the SMILES notation for N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide?
The canonical SMILES for N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide is CCCC(=O)NCCC(=O)NCCOC.
What is the InChIKey of N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide?
The InChIKey is CJBOPGUKAKGYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-3-4-9(13)11-6-5-10(14)12-7-8-15-2/h3-8H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide?
N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide has a molecular weight of 216.28 g/mol, XLogP of 0.06, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide is sourced from PubChem (CID 115590611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).