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

C11H17N3O2 — CID 63590933

IUPAC3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide
SMILESCOc1cccc(NCCC(=O)N(C)C)n1
InChIInChI=1S/C11H17N3O2/c1-14(2)11(15)7-8-12-9-5-4-6-10(13-9)16-3/h4-6H,7-8H2,1-3H3,(H,12,13)
InChIKeyBDIGSJYHXAZCKP-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.98
Rot. Bonds5

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

3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide (PubChem CID 63590933) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide
PubChem CID63590933
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide
SMILESCOc1cccc(NCCC(=O)N(C)C)n1
InChIInChI=1S/C11H17N3O2/c1-14(2)11(15)7-8-12-9-5-4-6-10(13-9)16-3/h4-6H,7-8H2,1-3H3,(H,12,13)
InChIKeyBDIGSJYHXAZCKP-UHFFFAOYSA-N
XLogP0.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide (CID 63590933) is 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide is COc1cccc(NCCC(=O)N(C)C)n1.
What is the InChIKey of 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide?
The InChIKey is BDIGSJYHXAZCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-14(2)11(15)7-8-12-9-5-4-6-10(13-9)16-3/h4-6H,7-8H2,1-3H3,(H,12,13).
What are the key properties of 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide?
3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide has a molecular weight of 223.28 g/mol, XLogP of 0.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 63590933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).