1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one

C10H17NO2 — CID 102648336

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one
SMILESCNC(C)(C)C(=O)C1=CCCCO1
InChIInChI=1S/C10H17NO2/c1-10(2,11-3)9(12)8-6-4-5-7-13-8/h6,11H,4-5,7H2,1-3H3
InChIKeyYUZIIQMWVOWLMR-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.25
Rot. Bonds3

About 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one

1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one (PubChem CID 102648336) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one
PubChem CID102648336
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one
SMILESCNC(C)(C)C(=O)C1=CCCCO1
InChIInChI=1S/C10H17NO2/c1-10(2,11-3)9(12)8-6-4-5-7-13-8/h6,11H,4-5,7H2,1-3H3
InChIKeyYUZIIQMWVOWLMR-UHFFFAOYSA-N
XLogP1.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,4-dihydro-2H-pyran-6-yl)-2-(methylamino)ethan-1-one
CID 84020971
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylpropan-1-one
CID 102646932
2-(diethylamino)-1-(3,4-dihydro-2H-pyran-6-yl)-2-methylpropan-1-one
CID 102646933
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylbutan-1-one
CID 102646937
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-ethylbutan-1-one
CID 102646941
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
3-(tert-butylamino)-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-one
CID 102648304
2-amino-1-(3,4-dihydro-2H-pyran-6-yl)-2-methylpropan-1-one
CID 102648313
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

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one (CID 102648336) is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one is CNC(C)(C)C(=O)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one?
The InChIKey is YUZIIQMWVOWLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-10(2,11-3)9(12)8-6-4-5-7-13-8/h6,11H,4-5,7H2,1-3H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one?
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one has a molecular weight of 183.25 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-(methylamino)propan-1-one is sourced from PubChem (CID 102648336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).