N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide

C11H23N3O2 — CID 82731736

IUPACN-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide
SMILESCN(CCCN)C(=O)CN(C)C1CCOC1
InChIInChI=1S/C11H23N3O2/c1-13(6-3-5-12)11(15)8-14(2)10-4-7-16-9-10/h10H,3-9,12H2,1-2H3
InChIKeyUJQANNIPQTWHBM-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.49
Rot. Bonds6

About N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide

N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide (PubChem CID 82731736) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide
PubChem CID82731736
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide
SMILESCN(CCCN)C(=O)CN(C)C1CCOC1
InChIInChI=1S/C11H23N3O2/c1-13(6-3-5-12)11(15)8-14(2)10-4-7-16-9-10/h10H,3-9,12H2,1-2H3
InChIKeyUJQANNIPQTWHBM-UHFFFAOYSA-N
XLogP-0.49
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The IUPAC name of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide (CID 82731736) is N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The canonical SMILES for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide is CN(CCCN)C(=O)CN(C)C1CCOC1.
What is the InChIKey of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The InChIKey is UJQANNIPQTWHBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-13(6-3-5-12)11(15)8-14(2)10-4-7-16-9-10/h10H,3-9,12H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide has a molecular weight of 229.32 g/mol, XLogP of -0.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide is sourced from PubChem (CID 82731736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).