2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide

C11H18N4O2 — CID 113286418

IUPAC2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
SMILESCOc1ccc(N)c(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C11H18N4O2/c1-14(2)10(16)7-15(3)11-8(12)5-6-9(13-11)17-4/h5-6H,7,12H2,1-4H3
InChIKeyFUUGGYMSFLLXIN-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.20
Rot. Bonds4

About 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide

2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide (PubChem CID 113286418) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
PubChem CID113286418
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
SMILESCOc1ccc(N)c(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C11H18N4O2/c1-14(2)10(16)7-15(3)11-8(12)5-6-9(13-11)17-4/h5-6H,7,12H2,1-4H3
InChIKeyFUUGGYMSFLLXIN-UHFFFAOYSA-N
XLogP0.20
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide (CID 113286418) is 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide is COc1ccc(N)c(N(C)CC(=O)N(C)C)n1.
What is the InChIKey of 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The InChIKey is FUUGGYMSFLLXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-14(2)10(16)7-15(3)11-8(12)5-6-9(13-11)17-4/h5-6H,7,12H2,1-4H3.
What are the key properties of 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide has a molecular weight of 238.29 g/mol, XLogP of 0.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 113286418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).