3-[(6-methyl-2-pyridinyl)methylamino]propanamide

C10H15N3O — CID 62323562

IUPAC3-[(6-methyl-2-pyridinyl)methylamino]propanamide
SMILESCc1cccc(CNCCC(N)=O)n1
InChIInChI=1S/C10H15N3O/c1-8-3-2-4-9(13-8)7-12-6-5-10(11)14/h2-4,12H,5-7H2,1H3,(H2,11,14)
InChIKeyHPILGQKQPFPBEB-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.36
Rot. Bonds5

About 3-[(6-methyl-2-pyridinyl)methylamino]propanamide

3-[(6-methyl-2-pyridinyl)methylamino]propanamide (PubChem CID 62323562) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-[(6-methyl-2-pyridinyl)methylamino]propanamide.

Molecular Properties

Compound Name3-[(6-methyl-2-pyridinyl)methylamino]propanamide
PubChem CID62323562
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-[(6-methyl-2-pyridinyl)methylamino]propanamide
SMILESCc1cccc(CNCCC(N)=O)n1
InChIInChI=1S/C10H15N3O/c1-8-3-2-4-9(13-8)7-12-6-5-10(11)14/h2-4,12H,5-7H2,1H3,(H2,11,14)
InChIKeyHPILGQKQPFPBEB-UHFFFAOYSA-N
XLogP0.36
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.36
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

N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 14280569
3-[(6-methyl-2-pyridinyl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 113411343
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
methyl 6-[[2-[(6-methyl-2-pyridinyl)methylamino]ethylamino]methyl]pyridine-2-carboxylate
CID 170119871
3-amino-N-[(6-methyl-2-pyridinyl)methyl]-3-sulfanylidenepropanamide
CID 62306669
N-[(6-methyl-2-pyridinyl)methyl]-3-methylsulfanylpropan-1-amine
CID 60961143
2-[2-[(6-methyl-2-pyridinyl)methylamino]ethoxy]ethanol
CID 62323741
(2S)-2-amino-N-[(6-methyl-2-pyridinyl)methyl]butanamide
CID 79022904
2-amino-3-methyl-N-[(6-methyl-2-pyridinyl)methyl]butanamide
CID 62307698
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
CID 62332060
2-[(6-methyl-2-pyridinyl)methylamino]-2-oxoacetic acid
CID 62306859
N'-hydroxy-2,2-dimethyl-6-[(6-methyl-2-pyridinyl)methylamino]hexanimidamide
CID 106711107

Frequently Asked Questions

What is the IUPAC name of 3-[(6-methyl-2-pyridinyl)methylamino]propanamide?
The IUPAC name of 3-[(6-methyl-2-pyridinyl)methylamino]propanamide (CID 62323562) is 3-[(6-methyl-2-pyridinyl)methylamino]propanamide.
What is the SMILES notation for 3-[(6-methyl-2-pyridinyl)methylamino]propanamide?
The canonical SMILES for 3-[(6-methyl-2-pyridinyl)methylamino]propanamide is Cc1cccc(CNCCC(N)=O)n1.
What is the InChIKey of 3-[(6-methyl-2-pyridinyl)methylamino]propanamide?
The InChIKey is HPILGQKQPFPBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-3-2-4-9(13-8)7-12-6-5-10(11)14/h2-4,12H,5-7H2,1H3,(H2,11,14).
What are the key properties of 3-[(6-methyl-2-pyridinyl)methylamino]propanamide?
3-[(6-methyl-2-pyridinyl)methylamino]propanamide has a molecular weight of 193.25 g/mol, XLogP of 0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methyl-2-pyridinyl)methylamino]propanamide is sourced from PubChem (CID 62323562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).