2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide

C11H23N3O2 — CID 82743952

IUPAC2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide
SMILESCCNC(CN(C)C1CCOC1C)C(N)=O
InChIInChI=1S/C11H23N3O2/c1-4-13-9(11(12)15)7-14(3)10-5-6-16-8(10)2/h8-10,13H,4-7H2,1-3H3,(H2,12,15)
InChIKeyRQDNLULBFYREHB-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds6

About 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide

2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide (PubChem CID 82743952) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide.

Molecular Properties

Compound Name2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide
PubChem CID82743952
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide
SMILESCCNC(CN(C)C1CCOC1C)C(N)=O
InChIInChI=1S/C11H23N3O2/c1-4-13-9(11(12)15)7-14(3)10-5-6-16-8(10)2/h8-10,13H,4-7H2,1-3H3,(H2,12,15)
InChIKeyRQDNLULBFYREHB-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide?
The IUPAC name of 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide (CID 82743952) is 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide.
What is the SMILES notation for 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide?
The canonical SMILES for 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide is CCNC(CN(C)C1CCOC1C)C(N)=O.
What is the InChIKey of 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide?
The InChIKey is RQDNLULBFYREHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-4-13-9(11(12)15)7-14(3)10-5-6-16-8(10)2/h8-10,13H,4-7H2,1-3H3,(H2,12,15).
What are the key properties of 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide?
2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]propanamide is sourced from PubChem (CID 82743952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).