3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide

C10H20N2O2 — CID 116850358

IUPAC3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide
SMILESCN(C)C(=O)CC(N)C1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-12(2)10(13)7-9(11)8-3-5-14-6-4-8/h8-9H,3-7,11H2,1-2H3
InChIKeyOSOMBFIHOGJEDC-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.22
Rot. Bonds3

About 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide

3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide (PubChem CID 116850358) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide.

Molecular Properties

Compound Name3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide
PubChem CID116850358
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide
SMILESCN(C)C(=O)CC(N)C1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-12(2)10(13)7-9(11)8-3-5-14-6-4-8/h8-9H,3-7,11H2,1-2H3
InChIKeyOSOMBFIHOGJEDC-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide?
The IUPAC name of 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide (CID 116850358) is 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide.
What is the SMILES notation for 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide?
The canonical SMILES for 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide is CN(C)C(=O)CC(N)C1CCOCC1.
What is the InChIKey of 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide?
The InChIKey is OSOMBFIHOGJEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-12(2)10(13)7-9(11)8-3-5-14-6-4-8/h8-9H,3-7,11H2,1-2H3.
What are the key properties of 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide?
3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide has a molecular weight of 200.28 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-dimethyl-3-(oxan-4-yl)propanamide is sourced from PubChem (CID 116850358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).