3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one

C10H13ClN2O — CID 105466410

IUPAC3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one
SMILESCc1c(Cl)c(C)n(C2CC2)c(=O)c1N
InChIInChI=1S/C10H13ClN2O/c1-5-8(11)6(2)13(7-3-4-7)10(14)9(5)12/h7H,3-4,12H2,1-2H3
InChIKeyDZLDDDGJLLUKQS-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.04
Rot. Bonds1

About 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one

3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one (PubChem CID 105466410) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one.

Molecular Properties

Compound Name3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one
PubChem CID105466410
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one
SMILESCc1c(Cl)c(C)n(C2CC2)c(=O)c1N
InChIInChI=1S/C10H13ClN2O/c1-5-8(11)6(2)13(7-3-4-7)10(14)9(5)12/h7H,3-4,12H2,1-2H3
InChIKeyDZLDDDGJLLUKQS-UHFFFAOYSA-N
XLogP2.04
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one?
The IUPAC name of 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one (CID 105466410) is 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one.
What is the SMILES notation for 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one?
The canonical SMILES for 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one is Cc1c(Cl)c(C)n(C2CC2)c(=O)c1N.
What is the InChIKey of 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one?
The InChIKey is DZLDDDGJLLUKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c1-5-8(11)6(2)13(7-3-4-7)10(14)9(5)12/h7H,3-4,12H2,1-2H3.
What are the key properties of 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one?
3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one has a molecular weight of 212.68 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-chloro-1-cyclopropyl-4,6-dimethylpyridin-2-one is sourced from PubChem (CID 105466410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).