4-(dimethylamino)-1-propan-2-ylpiperidin-2-one

C10H20N2O — CID 149452185

IUPAC4-(dimethylamino)-1-propan-2-ylpiperidin-2-one
SMILESCC(C)N1CCC(N(C)C)CC1=O
InChIInChI=1S/C10H20N2O/c1-8(2)12-6-5-9(11(3)4)7-10(12)13/h8-9H,5-7H2,1-4H3
InChIKeyYXVXTGGKAZNBFM-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.95
Rot. Bonds2

About 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one

4-(dimethylamino)-1-propan-2-ylpiperidin-2-one (PubChem CID 149452185) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one.

Molecular Properties

Compound Name4-(dimethylamino)-1-propan-2-ylpiperidin-2-one
PubChem CID149452185
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-(dimethylamino)-1-propan-2-ylpiperidin-2-one
SMILESCC(C)N1CCC(N(C)C)CC1=O
InChIInChI=1S/C10H20N2O/c1-8(2)12-6-5-9(11(3)4)7-10(12)13/h8-9H,5-7H2,1-4H3
InChIKeyYXVXTGGKAZNBFM-UHFFFAOYSA-N
XLogP0.95
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-4-methyl-1-propan-2-ylpiperidin-2-one
CID 146189897
1,4-di(propan-2-yl)piperidin-2-one
CID 59815013
(4aS,9aR)-7-propan-2-yl-2,3,4,4a,5,8,9,9a-octahydro-1H-pyrido[3,4-d]azepin-6-one
CID 26742764
(3R)-5-oxo-1-propan-2-ylpyrrolidine-3-carbaldehyde
CID 97182050
4-(aminomethyl)-1-propan-2-ylpyrrolidin-2-one
CID 44827665
3-fluoro-1-propan-2-ylpyrrolidin-2-one
CID 45088052
1,3-di(propan-2-yl)pyrrolidin-2-one;methane
CID 158114726
4-(3-methoxypyrrolidine-1-carbonyl)-1-propan-2-ylpyrrolidin-2-one
CID 108754227
4-[[4-(3-methyl-2-oxobutyl)piperazin-1-yl]methyl]-1-propan-2-ylpiperidin-2-one
CID 177119210
(3S)-N-cyclopropyl-5-oxo-1-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 97017758
(4R)-4-cyclopropyl-1-propan-2-ylimidazolidin-2-one
CID 176750415
ethane;4-propan-2-ylthiomorpholin-3-one
CID 143160697

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one?
The IUPAC name of 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one (CID 149452185) is 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one.
What is the SMILES notation for 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one?
The canonical SMILES for 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one is CC(C)N1CCC(N(C)C)CC1=O.
What is the InChIKey of 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one?
The InChIKey is YXVXTGGKAZNBFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)12-6-5-9(11(3)4)7-10(12)13/h8-9H,5-7H2,1-4H3.
What are the key properties of 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one?
4-(dimethylamino)-1-propan-2-ylpiperidin-2-one has a molecular weight of 184.28 g/mol, XLogP of 0.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-1-propan-2-ylpiperidin-2-one is sourced from PubChem (CID 149452185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).