3-(4-propylpiperidin-3-yl)oxiran-2-amine

C10H20N2O — CID 123367852

IUPAC3-(4-propylpiperidin-3-yl)oxiran-2-amine
SMILESCCCC1CCNCC1C1OC1N
InChIInChI=1S/C10H20N2O/c1-2-3-7-4-5-12-6-8(7)9-10(11)13-9/h7-10,12H,2-6,11H2,1H3
InChIKeyUQZLEGXNPVXUBM-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.70
Rot. Bonds3

About 3-(4-propylpiperidin-3-yl)oxiran-2-amine

3-(4-propylpiperidin-3-yl)oxiran-2-amine (PubChem CID 123367852) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(4-propylpiperidin-3-yl)oxiran-2-amine.

Molecular Properties

Compound Name3-(4-propylpiperidin-3-yl)oxiran-2-amine
PubChem CID123367852
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(4-propylpiperidin-3-yl)oxiran-2-amine
SMILESCCCC1CCNCC1C1OC1N
InChIInChI=1S/C10H20N2O/c1-2-3-7-4-5-12-6-8(7)9-10(11)13-9/h7-10,12H,2-6,11H2,1H3
InChIKeyUQZLEGXNPVXUBM-UHFFFAOYSA-N
XLogP0.70
TPSA50.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 3-(4-propylpiperidin-3-yl)oxiran-2-amine 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

ethyl (4R)-4-propylpiperidine-3-carboxylate
CID 121479190
2-(3-propylpiperidin-4-yl)acetic acid
CID 84660229
4-fluoro-5-propylazepane
CID 84650925
3-methylpiperidin-4-amine;dihydrochloride
CID 155921065
7-propyl-1,4-oxazepane
CID 165441817
ethane;7-propyl-6-oxa-3-azabicyclo[3.2.0]heptane
CID 142053051
(1R,6S,8R)-3-azabicyclo[4.2.0]octan-8-amine
CID 22862086
(4aS,7R,7aS)-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridin-7-amine;hydrochloride
CID 155905230
ethane;N-methyl-4-propylpiperidine-3-carboximidoyl cyanide
CID 143250244
4-(4-phenylphenyl)-3-propylpiperidine
CID 79310826
4-(4-cyclopropylphenyl)-3-propylpiperidine
CID 79978393
4-(2,3-dichlorophenyl)-3-propylpiperidine
CID 79320625

Frequently Asked Questions

What is the IUPAC name of 3-(4-propylpiperidin-3-yl)oxiran-2-amine?
The IUPAC name of 3-(4-propylpiperidin-3-yl)oxiran-2-amine (CID 123367852) is 3-(4-propylpiperidin-3-yl)oxiran-2-amine.
What is the SMILES notation for 3-(4-propylpiperidin-3-yl)oxiran-2-amine?
The canonical SMILES for 3-(4-propylpiperidin-3-yl)oxiran-2-amine is CCCC1CCNCC1C1OC1N.
What is the InChIKey of 3-(4-propylpiperidin-3-yl)oxiran-2-amine?
The InChIKey is UQZLEGXNPVXUBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-3-7-4-5-12-6-8(7)9-10(11)13-9/h7-10,12H,2-6,11H2,1H3.
What are the key properties of 3-(4-propylpiperidin-3-yl)oxiran-2-amine?
3-(4-propylpiperidin-3-yl)oxiran-2-amine has a molecular weight of 184.28 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propylpiperidin-3-yl)oxiran-2-amine is sourced from PubChem (CID 123367852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).