4-ethoxy-N-(2-hydroxyethyl)butanamide

C8H17NO3 — CID 112728032

IUPAC4-ethoxy-N-(2-hydroxyethyl)butanamide
SMILESCCOCCCC(=O)NCCO
InChIInChI=1S/C8H17NO3/c1-2-12-7-3-4-8(11)9-5-6-10/h10H,2-7H2,1H3,(H,9,11)
InChIKeyPJOGQSMDMANPCX-UHFFFAOYSA-N
MW175.23 g/mol
LogP-0.09
Rot. Bonds7

About 4-ethoxy-N-(2-hydroxyethyl)butanamide

4-ethoxy-N-(2-hydroxyethyl)butanamide (PubChem CID 112728032) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-ethoxy-N-(2-hydroxyethyl)butanamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-hydroxyethyl)butanamide
PubChem CID112728032
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC Name4-ethoxy-N-(2-hydroxyethyl)butanamide
SMILESCCOCCCC(=O)NCCO
InChIInChI=1S/C8H17NO3/c1-2-12-7-3-4-8(11)9-5-6-10/h10H,2-7H2,1H3,(H,9,11)
InChIKeyPJOGQSMDMANPCX-UHFFFAOYSA-N
XLogP-0.09
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 5-0.09
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

4-ethoxy-N-pent-4-ynylbutanamide
CID 103708929
ethane;4-ethoxy-N-[4-(propan-2-ylamino)butyl]butanamide
CID 162749925
4-ethoxy-N-prop-2-enylbutanamide
CID 112728026
4-ethoxy-N-[3-[2-[2-[3-(ethylamino)propoxy]ethoxy]ethoxy]propyl]butanamide;molecular hydrogen
CID 162749894
ethane;4-ethoxy-N-(2-methylsulfonylethyl)butanamide;methanethiol
CID 166155063
N-(3-ethoxypropyl)-3-(ethylamino)propanamide
CID 62832106
4-ethoxy-N-(2-methylprop-2-enyl)butanamide
CID 114618597
N'-[3-[2-[2-[3-(3-chloropropanoylamino)propoxy]ethoxy]ethoxy]propyl]-N-(3-ethoxypropyl)pentanediamide
CID 126550925
N-(4-azidobutyl)-4-ethoxybutanamide
CID 106386746
N-(2-hydroxyethyl)pentacosanamide
CID 14455162
N-(2-hydroxyethyl)heptadecanamide
CID 14455158
N-(3-butoxypropyl)-5-hydroxypentanamide
CID 115886729

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(2-hydroxyethyl)butanamide?
The IUPAC name of 4-ethoxy-N-(2-hydroxyethyl)butanamide (CID 112728032) is 4-ethoxy-N-(2-hydroxyethyl)butanamide.
What is the SMILES notation for 4-ethoxy-N-(2-hydroxyethyl)butanamide?
The canonical SMILES for 4-ethoxy-N-(2-hydroxyethyl)butanamide is CCOCCCC(=O)NCCO.
What is the InChIKey of 4-ethoxy-N-(2-hydroxyethyl)butanamide?
The InChIKey is PJOGQSMDMANPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c1-2-12-7-3-4-8(11)9-5-6-10/h10H,2-7H2,1H3,(H,9,11).
What are the key properties of 4-ethoxy-N-(2-hydroxyethyl)butanamide?
4-ethoxy-N-(2-hydroxyethyl)butanamide has a molecular weight of 175.23 g/mol, XLogP of -0.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-hydroxyethyl)butanamide is sourced from PubChem (CID 112728032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).