N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide

C11H24N2O2 — CID 115734235

IUPACN-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide
SMILESCCOC(C)CNC(=O)CCNC(C)C
InChIInChI=1S/C11H24N2O2/c1-5-15-10(4)8-13-11(14)6-7-12-9(2)3/h9-10,12H,5-8H2,1-4H3,(H,13,14)
InChIKeyYJUKTPJQYDYAKA-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.92
Rot. Bonds8

About N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide

N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide (PubChem CID 115734235) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide
PubChem CID115734235
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide
SMILESCCOC(C)CNC(=O)CCNC(C)C
InChIInChI=1S/C11H24N2O2/c1-5-15-10(4)8-13-11(14)6-7-12-9(2)3/h9-10,12H,5-8H2,1-4H3,(H,13,14)
InChIKeyYJUKTPJQYDYAKA-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide?
The IUPAC name of N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide (CID 115734235) is N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide.
What is the SMILES notation for N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide?
The canonical SMILES for N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide is CCOC(C)CNC(=O)CCNC(C)C.
What is the InChIKey of N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide?
The InChIKey is YJUKTPJQYDYAKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-15-10(4)8-13-11(14)6-7-12-9(2)3/h9-10,12H,5-8H2,1-4H3,(H,13,14).
What are the key properties of N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide?
N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxypropyl)-3-(propan-2-ylamino)propanamide is sourced from PubChem (CID 115734235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).