3,4-dihydro-2H-pyran-2-amine

C5H9NO — CID 67079662

IUPAC3,4-dihydro-2H-pyran-2-amine
SMILESNC1CCC=CO1
InChIInChI=1S/C5H9NO/c6-5-3-1-2-4-7-5/h2,4-5H,1,3,6H2
InChIKeyUUGGFDLSYLNAKB-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.60
Rot. Bonds

About 3,4-dihydro-2H-pyran-2-amine

3,4-dihydro-2H-pyran-2-amine (PubChem CID 67079662) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-2-amine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-2-amine
PubChem CID67079662
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name3,4-dihydro-2H-pyran-2-amine
SMILESNC1CCC=CO1
InChIInChI=1S/C5H9NO/c6-5-3-1-2-4-7-5/h2,4-5H,1,3,6H2
InChIKeyUUGGFDLSYLNAKB-UHFFFAOYSA-N
XLogP0.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,4-dihydro-2H-pyran-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

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-2-amine?
The IUPAC name of 3,4-dihydro-2H-pyran-2-amine (CID 67079662) is 3,4-dihydro-2H-pyran-2-amine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-2-amine?
The canonical SMILES for 3,4-dihydro-2H-pyran-2-amine is NC1CCC=CO1.
What is the InChIKey of 3,4-dihydro-2H-pyran-2-amine?
The InChIKey is UUGGFDLSYLNAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c6-5-3-1-2-4-7-5/h2,4-5H,1,3,6H2.
What are the key properties of 3,4-dihydro-2H-pyran-2-amine?
3,4-dihydro-2H-pyran-2-amine has a molecular weight of 99.13 g/mol, XLogP of 0.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-2-amine is sourced from PubChem (CID 67079662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).