3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine

C11H15NO2 — CID 104804172

IUPAC3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine
SMILESCc1ccoc1C(N)C1=COCCC1
InChIInChI=1S/C11H15NO2/c1-8-4-6-14-11(8)10(12)9-3-2-5-13-7-9/h4,6-7,10H,2-3,5,12H2,1H3
InChIKeyNDPJEGKKAJDIJK-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.28
Rot. Bonds2

About 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine

3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine (PubChem CID 104804172) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine
PubChem CID104804172
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine
SMILESCc1ccoc1C(N)C1=COCCC1
InChIInChI=1S/C11H15NO2/c1-8-4-6-14-11(8)10(12)9-3-2-5-13-7-9/h4,6-7,10H,2-3,5,12H2,1H3
InChIKeyNDPJEGKKAJDIJK-UHFFFAOYSA-N
XLogP2.28
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-2-methylphenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033406
(3-chloro-2-methylphenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 107103040
(3-chloro-4-methylthiophen-2-yl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 103407202
(5-bromo-4-methylthiophen-2-yl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033503
3,4-dihydro-2H-pyran-5-yl-(5-ethylthiophen-2-yl)methanamine
CID 105033479
2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033272
(2,4-dibromophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 107946680
(2,3-dichlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033531
furan-3-yl-(3-methylfuran-2-yl)methanamine
CID 104804500
(4-butoxyphenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105179416
1-(3,4-dihydro-2H-pyran-5-yl)-3-(4-methylphenyl)propan-1-amine
CID 105179419
1,3-dihydro-2-benzofuran-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033357

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine?
The IUPAC name of 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine (CID 104804172) is 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine?
The canonical SMILES for 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine is Cc1ccoc1C(N)C1=COCCC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine?
The InChIKey is NDPJEGKKAJDIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-4-6-14-11(8)10(12)9-3-2-5-13-7-9/h4,6-7,10H,2-3,5,12H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine?
3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine has a molecular weight of 193.25 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-5-yl-(3-methylfuran-2-yl)methanamine is sourced from PubChem (CID 104804172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).