N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide

C11H17N3O — CID 62996029

IUPACN-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide
SMILESCNC(=O)CCNCc1ccc(C)nc1
InChIInChI=1S/C11H17N3O/c1-9-3-4-10(8-14-9)7-13-6-5-11(15)12-2/h3-4,8,13H,5-7H2,1-2H3,(H,12,15)
InChIKeyWWAURTDYZNXUOY-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.62
Rot. Bonds5

About N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide

N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide (PubChem CID 62996029) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide.

Molecular Properties

Compound NameN-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide
PubChem CID62996029
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide
SMILESCNC(=O)CCNCc1ccc(C)nc1
InChIInChI=1S/C11H17N3O/c1-9-3-4-10(8-14-9)7-13-6-5-11(15)12-2/h3-4,8,13H,5-7H2,1-2H3,(H,12,15)
InChIKeyWWAURTDYZNXUOY-UHFFFAOYSA-N
XLogP0.62
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(6-chloro-3-pyridinyl)methylamino]-N-methylpropanamide
CID 115683654
2-fluoro-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 80695988
N-methyl-2-[2-[(6-methyl-3-pyridinyl)methylamino]phenyl]acetamide
CID 104756616
3-[(5-hydroxy-2-pyridinyl)methylamino]-N-methylpropanamide
CID 79783660
N,N-dimethyl-2-[(6-methyl-3-pyridinyl)methylamino]acetamide
CID 62995684
N-[(6-methyl-3-pyridinyl)methyl]heptan-1-amine
CID 62996508
3-(furan-3-ylmethylamino)-N-methylpropanamide
CID 63204466
ethane;N'-[(6-methyl-3-pyridinyl)methyl]butane-1,4-diamine
CID 145198308
2-amino-3-[(6-methyl-3-pyridinyl)methylamino]propanoic acid
CID 64584052
N-methyl-3-[(2-methylpyrimidin-4-yl)methylamino]propanamide
CID 62326409
5-[(6-methyl-3-pyridinyl)methylamino]-5-oxopentanoic acid
CID 62996023
5-[[[3-(methylamino)-3-oxopropyl]carbamoylamino]methyl]pyridine-2-carboxylic acid
CID 81096535

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The IUPAC name of N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide (CID 62996029) is N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide.
What is the SMILES notation for N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The canonical SMILES for N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide is CNC(=O)CCNCc1ccc(C)nc1.
What is the InChIKey of N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The InChIKey is WWAURTDYZNXUOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-3-4-10(8-14-9)7-13-6-5-11(15)12-2/h3-4,8,13H,5-7H2,1-2H3,(H,12,15).
What are the key properties of N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide?
N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide has a molecular weight of 207.28 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(6-methyl-3-pyridinyl)methylamino]propanamide is sourced from PubChem (CID 62996029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).