2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine

C15H19NO — CID 105033272

IUPAC2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
SMILESNC(C1=COCCC1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H19NO/c16-15(14-5-2-8-17-10-14)13-7-6-11-3-1-4-12(11)9-13/h6-7,9-10,15H,1-5,8,16H2
InChIKeyAYAJUPFNWWDOPA-UHFFFAOYSA-N
MW229.32 g/mol
LogP2.87
Rot. Bonds2

About 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine

2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine (PubChem CID 105033272) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
PubChem CID105033272
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
SMILESNC(C1=COCCC1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H19NO/c16-15(14-5-2-8-17-10-14)13-7-6-11-3-1-4-12(11)9-13/h6-7,9-10,15H,1-5,8,16H2
InChIKeyAYAJUPFNWWDOPA-UHFFFAOYSA-N
XLogP2.87
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dihydro-2-benzofuran-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033357
[4-bromo-3-(trifluoromethyl)phenyl]-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033153
2,3-dihydro-1H-inden-5-ylmethanediamine
CID 116939135
2,3-dihydro-1H-inden-5-yl-(4-propan-2-ylphenyl)methanamine
CID 43115552
(3,5-dichlorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanamine
CID 43115602
(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 144541952
(4-methylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43095172
cyclohexen-1-yl(1,3-dihydro-2-benzofuran-5-yl)methanamine
CID 55231459
2,3-dihydro-1H-inden-5-yl-(2-methylfuran-3-yl)methanamine
CID 43464481
(2,4-dibromophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 107946680
2,3-dihydro-1H-inden-5-yl-(2,4,6-trifluorophenyl)methanamine
CID 43198708
(2,6-difluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanamine
CID 43115569

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine (CID 105033272) is 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine is NC(C1=COCCC1)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine?
The InChIKey is AYAJUPFNWWDOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c16-15(14-5-2-8-17-10-14)13-7-6-11-3-1-4-12(11)9-13/h6-7,9-10,15H,1-5,8,16H2.
What are the key properties of 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine?
2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine has a molecular weight of 229.32 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine is sourced from PubChem (CID 105033272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).