3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one

C12H20N2O — CID 105462267

IUPAC3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one
SMILESCC(C)Cc1ccc(N)c(=O)n1C(C)C
InChIInChI=1S/C12H20N2O/c1-8(2)7-10-5-6-11(13)12(15)14(10)9(3)4/h5-6,8-9H,7,13H2,1-4H3
InChIKeyBDRCBAQCTHBPAJ-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.21
Rot. Bonds3

About 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one

3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one (PubChem CID 105462267) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one.

Molecular Properties

Compound Name3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one
PubChem CID105462267
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one
SMILESCC(C)Cc1ccc(N)c(=O)n1C(C)C
InChIInChI=1S/C12H20N2O/c1-8(2)7-10-5-6-11(13)12(15)14(10)9(3)4/h5-6,8-9H,7,13H2,1-4H3
InChIKeyBDRCBAQCTHBPAJ-UHFFFAOYSA-N
XLogP2.21
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)acetamide
CID 59268968
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CID 164636706
3-Amino-1-[(4-fluorocyclohexa-2,4-dien-1-yl)methyl]-6,7-dihydroquinolin-2-one
CID 123688124
3-amino-7-ethyl-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepin-2-one
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N-(6-butyl-2-oxo-1H-pyridin-3-yl)-N,2-dimethylpropanamide
CID 19012345
3-Amino-1-butyl-5,6-dimethyl-2-pyridone
CID 22266463
3-Amino-5-tert-butyl-1-methylpyridin-2-one
CID 58980646
(4,6-Dimethyl-2-oxo-1-propan-2-yl-3-pyridinyl)azanide;tungsten
CID 59885533
N-ethyl-3a,7a-dihydro-1H-indole-2-carboxamide
CID 68348244
2-(dimethylamino)-N-[(5S)-5-methylcyclohexa-1,3-dien-1-yl]acetamide
CID 89024054
1-Ethyl-6-(2-methylpropyl)pyridin-2-one
CID 89027269
(2E,4E)-2-amino-N-butyl-4-methylhexa-2,4-dienamide
CID 89153676

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one?
The IUPAC name of 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one (CID 105462267) is 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one.
What is the SMILES notation for 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one?
The canonical SMILES for 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one is CC(C)Cc1ccc(N)c(=O)n1C(C)C.
What is the InChIKey of 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one?
The InChIKey is BDRCBAQCTHBPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-8(2)7-10-5-6-11(13)12(15)14(10)9(3)4/h5-6,8-9H,7,13H2,1-4H3.
What are the key properties of 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one?
3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one has a molecular weight of 208.30 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(2-methylpropyl)-1-propan-2-ylpyridin-2-one is sourced from PubChem (CID 105462267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).