N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide

C11H24N2O2 — CID 60850792

IUPACN-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide
SMILESCCOCCNC(=O)CCCNC(C)C
InChIInChI=1S/C11H24N2O2/c1-4-15-9-8-13-11(14)6-5-7-12-10(2)3/h10,12H,4-9H2,1-3H3,(H,13,14)
InChIKeyQEVVAIRJCWTZCY-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.92
Rot. Bonds9

About N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide

N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide (PubChem CID 60850792) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide
PubChem CID60850792
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide
SMILESCCOCCNC(=O)CCCNC(C)C
InChIInChI=1S/C11H24N2O2/c1-4-15-9-8-13-11(14)6-5-7-12-10(2)3/h10,12H,4-9H2,1-3H3,(H,13,14)
InChIKeyQEVVAIRJCWTZCY-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.92
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

ethane;4-ethoxy-N-[4-(propan-2-ylamino)butyl]butanamide
CID 162749925
N-butyl-4-(propan-2-ylamino)butanamide
CID 60851986
N-[2-[2-(6-methylheptylamino)-2-oxoethoxy]ethyl]-4-(propan-2-ylamino)butanamide
CID 170416222
N-[2-[2-(3-methyl-2-oxobutoxy)ethoxy]ethyl]-6-oxo-9-(propan-2-ylamino)nonanamide
CID 170116965
4-methyl-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 171803932
CID 169190202
CID 169190202
5-ethoxy-N-[2-(3-methylbutoxy)ethyl]pentanamide;molecular hydrogen
CID 177338046
N-ethyl-3-[3-(propan-2-ylamino)propoxy]propanamide
CID 62342053
N-[2-(diethylamino)ethyl]-4-(propan-2-ylamino)butanamide
CID 60849509
18-[[6-(2-ethoxyethylamino)-6-oxohexyl]amino]-18-oxooctadecanoic acid
CID 176877409
N-(2-ethoxyethyl)-3-methylbutanamide
CID 58439580
N-(2-methylpropyl)-4-(propan-2-ylamino)butanamide
CID 60850925

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide?
The IUPAC name of N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide (CID 60850792) is N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide.
What is the SMILES notation for N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide?
The canonical SMILES for N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide is CCOCCNC(=O)CCCNC(C)C.
What is the InChIKey of N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide?
The InChIKey is QEVVAIRJCWTZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-15-9-8-13-11(14)6-5-7-12-10(2)3/h10,12H,4-9H2,1-3H3,(H,13,14).
What are the key properties of N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide?
N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide has a molecular weight of 216.32 g/mol, XLogP of 0.92, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-4-(propan-2-ylamino)butanamide is sourced from PubChem (CID 60850792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).