2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone

C10H15NO2 — CID 102648294

IUPAC2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
SMILESO=C(CNC1CC1)C1=CCCCO1
InChIInChI=1S/C10H15NO2/c12-9(7-11-8-4-5-8)10-3-1-2-6-13-10/h3,8,11H,1-2,4-7H2
InChIKeyIVILQMUFJUFQSX-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.00
Rot. Bonds4

About 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone

2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone (PubChem CID 102648294) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone.

Molecular Properties

Compound Name2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
PubChem CID102648294
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
SMILESO=C(CNC1CC1)C1=CCCCO1
InChIInChI=1S/C10H15NO2/c12-9(7-11-8-4-5-8)10-3-1-2-6-13-10/h3,8,11H,1-2,4-7H2
InChIKeyIVILQMUFJUFQSX-UHFFFAOYSA-N
XLogP1.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dihydro-2H-pyran-6-yl)-2-(2,2,2-trifluoroethylamino)ethanone
CID 102648414
1-(3,4-dihydro-2H-pyran-6-yl)-2-(methylamino)ethan-1-one
CID 84020971
1-(3,4-dihydro-2H-pyran-6-yl)-2-(propan-2-ylamino)ethanone
CID 102648293
2-(butan-2-ylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
CID 102648298
2-(cyclopropylmethylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
CID 102648303
2-(cyclopentylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
CID 102648308
3-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-one
CID 102648309
1-(3,4-dihydro-2H-pyran-6-yl)-2-(ethylamino)ethanone
CID 102648322
1-(3,4-dihydro-2H-pyran-6-yl)-2-(propylamino)ethanone
CID 102648323
1-(3,4-dihydro-2H-pyran-6-yl)-2-(methylamino)propan-1-one
CID 102648331
1-(3,4-dihydro-2H-pyran-6-yl)-2-(ethylamino)-2-methylpropan-1-one
CID 102648335
2-(tert-butylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
CID 102648415

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone?
The IUPAC name of 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone (CID 102648294) is 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone.
What is the SMILES notation for 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone?
The canonical SMILES for 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone is O=C(CNC1CC1)C1=CCCCO1.
What is the InChIKey of 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone?
The InChIKey is IVILQMUFJUFQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c12-9(7-11-8-4-5-8)10-3-1-2-6-13-10/h3,8,11H,1-2,4-7H2.
What are the key properties of 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone?
2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone has a molecular weight of 181.23 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-1-(3,4-dihydro-2H-pyran-6-yl)ethanone is sourced from PubChem (CID 102648294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).