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

C6H11NO — CID 90932214

IUPAC5-methyl-3,4-dihydro-2H-pyran-2-amine
SMILESCC1=COC(N)CC1
InChIInChI=1S/C6H11NO/c1-5-2-3-6(7)8-4-5/h4,6H,2-3,7H2,1H3
InChIKeyQUDARBFTUBKTAN-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.99
Rot. Bonds

About 5-methyl-3,4-dihydro-2H-pyran-2-amine

5-methyl-3,4-dihydro-2H-pyran-2-amine (PubChem CID 90932214) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 5-methyl-3,4-dihydro-2H-pyran-2-amine.

Molecular Properties

Compound Name5-methyl-3,4-dihydro-2H-pyran-2-amine
PubChem CID90932214
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name5-methyl-3,4-dihydro-2H-pyran-2-amine
SMILESCC1=COC(N)CC1
InChIInChI=1S/C6H11NO/c1-5-2-3-6(7)8-4-5/h4,6H,2-3,7H2,1H3
InChIKeyQUDARBFTUBKTAN-UHFFFAOYSA-N
XLogP0.99
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-pyran-5-yl)-2-fluoroethan-1-amine
CID 104059467
5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine
CID 91511758
5-ethyl-3,4-dihydro-2H-pyran-2-amine
CID 91531212
(5-methyl-4H-pyran-3-yl)methanamine
CID 143517599
2-(3,4-dihydro-2H-pyran-5-yl)ethan-1-amine
CID 55254109
(3,4-Dihydro-2h-pyran-5-yl)methanamine
CID 104058857
3-(3,4-dihydro-2H-pyran-5-yl)propan-1-amine
CID 165652964

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3,4-dihydro-2H-pyran-2-amine?
The IUPAC name of 5-methyl-3,4-dihydro-2H-pyran-2-amine (CID 90932214) is 5-methyl-3,4-dihydro-2H-pyran-2-amine.
What is the SMILES notation for 5-methyl-3,4-dihydro-2H-pyran-2-amine?
The canonical SMILES for 5-methyl-3,4-dihydro-2H-pyran-2-amine is CC1=COC(N)CC1.
What is the InChIKey of 5-methyl-3,4-dihydro-2H-pyran-2-amine?
The InChIKey is QUDARBFTUBKTAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-5-2-3-6(7)8-4-5/h4,6H,2-3,7H2,1H3.
What are the key properties of 5-methyl-3,4-dihydro-2H-pyran-2-amine?
5-methyl-3,4-dihydro-2H-pyran-2-amine has a molecular weight of 113.16 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3,4-dihydro-2H-pyran-2-amine is sourced from PubChem (CID 90932214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).