5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine

C8H15NO — CID 91511758

IUPAC5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine
SMILESCC(C)C1=COC(N)CC1
InChIInChI=1S/C8H15NO/c1-6(2)7-3-4-8(9)10-5-7/h5-6,8H,3-4,9H2,1-2H3
InChIKeyBXADBLODRYDERK-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.62
Rot. Bonds1

About 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine

5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine (PubChem CID 91511758) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine.

Molecular Properties

Compound Name5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine
PubChem CID91511758
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine
SMILESCC(C)C1=COC(N)CC1
InChIInChI=1S/C8H15NO/c1-6(2)7-3-4-8(9)10-5-7/h5-6,8H,3-4,9H2,1-2H3
InChIKeyBXADBLODRYDERK-UHFFFAOYSA-N
XLogP1.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-pyran-5-yl)-2-fluoropropan-1-amine
CID 104059476
3-(3,4-dihydro-2H-pyran-5-yl)-3-fluoro-2-methylpropan-1-amine
CID 130604685
3-(2,3-Dihydrofuran-4-yl)-3-fluoro-2-methylpropan-1-amine
CID 133666326
2-(3,4-dihydro-2H-pyran-5-yl)-3,3-difluoropropan-1-amine
CID 165722600
2-(3,4-dihydro-2H-pyran-5-yl)-3,3,3-trifluoropropan-1-amine
CID 165785379
5-methyl-3,4-dihydro-2H-pyran-2-amine
CID 90932214
5-ethyl-3,4-dihydro-2H-pyran-2-amine
CID 91531212
1-Methoxy-2,5-dimethylhex-5-en-1-amine
CID 123303711
2-(3,4-dihydro-2H-pyran-5-yl)ethan-1-amine
CID 55254109
2-(3,4-dihydro-2H-pyran-5-yl)cyclopropan-1-amine
CID 165652030
3-(3,4-dihydro-2H-pyran-5-yl)butan-1-amine
CID 165678796
2-(3,4-dihydro-2H-pyran-5-yl)propan-1-amine
CID 165686002

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine?
The IUPAC name of 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine (CID 91511758) is 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine.
What is the SMILES notation for 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine?
The canonical SMILES for 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine is CC(C)C1=COC(N)CC1.
What is the InChIKey of 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine?
The InChIKey is BXADBLODRYDERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6(2)7-3-4-8(9)10-5-7/h5-6,8H,3-4,9H2,1-2H3.
What are the key properties of 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine?
5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine has a molecular weight of 141.21 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-3,4-dihydro-2H-pyran-2-amine is sourced from PubChem (CID 91511758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).