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

C6H11NO — CID 174647776

IUPAC6-methyl-3,4-dihydro-2H-pyran-4-amine
SMILESCC1=CC(N)CCO1
InChIInChI=1S/C6H11NO/c1-5-4-6(7)2-3-8-5/h4,6H,2-3,7H2,1H3
InChIKeyFFUXNKZLEJPNGY-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.64
Rot. Bonds

About 6-methyl-3,4-dihydro-2H-pyran-4-amine

6-methyl-3,4-dihydro-2H-pyran-4-amine (PubChem CID 174647776) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 6-methyl-3,4-dihydro-2H-pyran-4-amine.

Molecular Properties

Compound Name6-methyl-3,4-dihydro-2H-pyran-4-amine
PubChem CID174647776
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name6-methyl-3,4-dihydro-2H-pyran-4-amine
SMILESCC1=CC(N)CCO1
InChIInChI=1S/C6H11NO/c1-5-4-6(7)2-3-8-5/h4,6H,2-3,7H2,1H3
InChIKeyFFUXNKZLEJPNGY-UHFFFAOYSA-N
XLogP0.64
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 ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4-dihydro-2H-pyran-4-amine?
The IUPAC name of 6-methyl-3,4-dihydro-2H-pyran-4-amine (CID 174647776) is 6-methyl-3,4-dihydro-2H-pyran-4-amine.
What is the SMILES notation for 6-methyl-3,4-dihydro-2H-pyran-4-amine?
The canonical SMILES for 6-methyl-3,4-dihydro-2H-pyran-4-amine is CC1=CC(N)CCO1.
What is the InChIKey of 6-methyl-3,4-dihydro-2H-pyran-4-amine?
The InChIKey is FFUXNKZLEJPNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-5-4-6(7)2-3-8-5/h4,6H,2-3,7H2,1H3.
What are the key properties of 6-methyl-3,4-dihydro-2H-pyran-4-amine?
6-methyl-3,4-dihydro-2H-pyran-4-amine has a molecular weight of 113.16 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4-dihydro-2H-pyran-4-amine is sourced from PubChem (CID 174647776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).