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

C8H16N2O2 — CID 43610037

IUPAC3-amino-N-(oxan-4-yl)propanamide
SMILESNCCC(=O)NC1CCOCC1
InChIInChI=1S/C8H16N2O2/c9-4-1-8(11)10-7-2-5-12-6-3-7/h7H,1-6,9H2,(H,10,11)
InChIKeyWMZDMEFZJYDWIG-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.37
Rot. Bonds3

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

3-amino-N-(oxan-4-yl)propanamide (PubChem CID 43610037) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 3-amino-N-(oxan-4-yl)propanamide.

Molecular Properties

Compound Name3-amino-N-(oxan-4-yl)propanamide
PubChem CID43610037
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name3-amino-N-(oxan-4-yl)propanamide
SMILESNCCC(=O)NC1CCOCC1
InChIInChI=1S/C8H16N2O2/c9-4-1-8(11)10-7-2-5-12-6-3-7/h7H,1-6,9H2,(H,10,11)
InChIKeyWMZDMEFZJYDWIG-UHFFFAOYSA-N
XLogP-0.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(oxan-4-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-hydroxy-N-(oxan-4-yl)pentanamide
CID 79191727
3-amino-N-(oxepan-4-yl)-3-sulfanylidenepropanamide
CID 130608137
3-amino-3-methyl-N-(oxan-4-yl)butanamide
CID 64684396
2-[2-aminoethyl(propyl)amino]-N-(oxan-4-yl)acetamide
CID 63099178
2-cyano-N-(oxan-4-yl)acetamide
CID 43610224
N-(oxan-4-yl)but-3-enamide
CID 134356735
(2S)-2-amino-4-(oxan-4-ylamino)-4-oxobutanoic acid
CID 70945523
N,N'-dicyclopropylbutanediamide
CID 5225156
2-(2-aminocyclohexyl)-N-(oxan-4-yl)acetamide
CID 62783525
2-(3-aminoazetidin-1-yl)-N-(oxan-4-yl)acetamide
CID 63760722
1-(aminomethyl)-N-(oxan-4-yl)cyclobutane-1-carboxamide
CID 80588748
N-(oxan-4-yl)-2-(oxan-4-ylmethylamino)acetamide
CID 63712370

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(oxan-4-yl)propanamide?
The IUPAC name of 3-amino-N-(oxan-4-yl)propanamide (CID 43610037) is 3-amino-N-(oxan-4-yl)propanamide.
What is the SMILES notation for 3-amino-N-(oxan-4-yl)propanamide?
The canonical SMILES for 3-amino-N-(oxan-4-yl)propanamide is NCCC(=O)NC1CCOCC1.
What is the InChIKey of 3-amino-N-(oxan-4-yl)propanamide?
The InChIKey is WMZDMEFZJYDWIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c9-4-1-8(11)10-7-2-5-12-6-3-7/h7H,1-6,9H2,(H,10,11).
What are the key properties of 3-amino-N-(oxan-4-yl)propanamide?
3-amino-N-(oxan-4-yl)propanamide has a molecular weight of 172.23 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(oxan-4-yl)propanamide is sourced from PubChem (CID 43610037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).