3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine

C13H23NO — CID 102649534

IUPAC3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2=CCCCO2)C1(C)C
InChIInChI=1S/C13H23NO/c1-12(2)11(13(12,3)4)10(14)9-7-5-6-8-15-9/h7,10-11H,5-6,8,14H2,1-4H3
InChIKeyGLBAYRUAVSVWBD-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.69
Rot. Bonds2

About 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine

3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine (PubChem CID 102649534) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
PubChem CID102649534
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2=CCCCO2)C1(C)C
InChIInChI=1S/C13H23NO/c1-12(2)11(13(12,3)4)10(14)9-7-5-6-8-15-9/h7,10-11H,5-6,8,14H2,1-4H3
InChIKeyGLBAYRUAVSVWBD-UHFFFAOYSA-N
XLogP2.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine
CID 131015027
1-(3,4-dihydro-2H-pyran-6-yl)-4-methylpentan-1-amine
CID 102647276
1-(3,4-dihydro-2H-pyran-6-yl)-3,3-dimethylbutan-1-amine
CID 102647451
cyclobutyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647501
3,4-dihydro-2H-pyran-6-yl-(2-methylcyclopropyl)methanamine
CID 102647623
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 102647624
N-[3,4-dihydro-2H-pyran-6-yl-(2-methylcyclopropyl)methyl]ethanamine
CID 102647625
N-[3,4-dihydro-2H-pyran-6-yl-(2-methylcyclopropyl)methyl]propan-1-amine
CID 102647626
3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
CID 102647873
2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102647881
2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylethanamine
CID 102647882
2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxyethanamine
CID 102648077

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine (CID 102649534) is 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine is CC1(C)C(C(N)C2=CCCCO2)C1(C)C.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The InChIKey is GLBAYRUAVSVWBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-12(2)11(13(12,3)4)10(14)9-7-5-6-8-15-9/h7,10-11H,5-6,8,14H2,1-4H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine has a molecular weight of 209.33 g/mol, XLogP of 2.69, 2 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-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine is sourced from PubChem (CID 102649534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).