3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide

C12H19N3O3 — CID 62668693

IUPAC3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
SMILESCOCCOc1ccc(NC(=O)C(C)CN)cn1
InChIInChI=1S/C12H19N3O3/c1-9(7-13)12(16)15-10-3-4-11(14-8-10)18-6-5-17-2/h3-4,8-9H,5-7,13H2,1-2H3,(H,15,16)
InChIKeyNEMNGTKYHOWGIT-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.64
Rot. Bonds7

About 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide

3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide (PubChem CID 62668693) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
PubChem CID62668693
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
SMILESCOCCOc1ccc(NC(=O)C(C)CN)cn1
InChIInChI=1S/C12H19N3O3/c1-9(7-13)12(16)15-10-3-4-11(14-8-10)18-6-5-17-2/h3-4,8-9H,5-7,13H2,1-2H3,(H,15,16)
InChIKeyNEMNGTKYHOWGIT-UHFFFAOYSA-N
XLogP0.64
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 43704147
3-amino-2-methyl-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide
CID 62669799
(2S,3S)-2-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-methylpentanamide
CID 61178172
6-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]hexanamide
CID 43704143
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 100773616
2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide
CID 60853381
2,2,3,3-tetrafluoro-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 103732741
1-(aminomethyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 115434828
N-[6-(2-methoxyethoxy)-3-pyridinyl]pyrazine-2-carboxamide
CID 43069859
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2H-triazole-4-carboxamide
CID 112733407
5-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pentanamide
CID 43697910

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide?
The IUPAC name of 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide (CID 62668693) is 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide.
What is the SMILES notation for 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide?
The canonical SMILES for 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide is COCCOc1ccc(NC(=O)C(C)CN)cn1.
What is the InChIKey of 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide?
The InChIKey is NEMNGTKYHOWGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-9(7-13)12(16)15-10-3-4-11(14-8-10)18-6-5-17-2/h3-4,8-9H,5-7,13H2,1-2H3,(H,15,16).
What are the key properties of 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide?
3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide has a molecular weight of 253.30 g/mol, XLogP of 0.64, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide is sourced from PubChem (CID 62668693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).