N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide

C12H19N3O2 — CID 79196186

IUPACN-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
SMILESCCOc1ncccc1NC(=O)C(C)CNC
InChIInChI=1S/C12H19N3O2/c1-4-17-12-10(6-5-7-14-12)15-11(16)9(2)8-13-3/h5-7,9,13H,4,8H2,1-3H3,(H,15,16)
InChIKeyJTUVBWLRGLKADF-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.27
Rot. Bonds6

About N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide

N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide (PubChem CID 79196186) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
PubChem CID79196186
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
SMILESCCOc1ncccc1NC(=O)C(C)CNC
InChIInChI=1S/C12H19N3O2/c1-4-17-12-10(6-5-7-14-12)15-11(16)9(2)8-13-3/h5-7,9,13H,4,8H2,1-3H3,(H,15,16)
InChIKeyJTUVBWLRGLKADF-UHFFFAOYSA-N
XLogP1.27
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 61178380
2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 43706630
N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 47177158
3-chloro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide
CID 62727393
2-amino-N-(2-ethoxy-3-pyridinyl)-2-phenylacetamide
CID 43706621
2-[(2-ethoxy-3-pyridinyl)amino]propanoic acid
CID 66173717
2-bromo-N-(2-ethoxy-3-pyridinyl)-2-methylpropanamide
CID 114327859
2-amino-N-(2-ethoxy-3-pyridinyl)-2-ethylbutanamide
CID 79809690
2-[2-(aminomethyl)phenyl]-N-(2-ethoxy-3-pyridinyl)acetamide
CID 81311348
6-amino-2-methyl-N-(2-propan-2-yloxy-3-pyridinyl)heptanamide
CID 65291888
N-[(2-methoxy-3-pyridinyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 79196113
1-amino-N-(2-ethoxy-3-pyridinyl)cyclopropane-1-carboxamide
CID 65467015

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide (CID 79196186) is N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide is CCOc1ncccc1NC(=O)C(C)CNC.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide?
The InChIKey is JTUVBWLRGLKADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-4-17-12-10(6-5-7-14-12)15-11(16)9(2)8-13-3/h5-7,9,13H,4,8H2,1-3H3,(H,15,16).
What are the key properties of N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide?
N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide has a molecular weight of 237.30 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 79196186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).