2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide

C12H19N3O2 — CID 106504045

IUPAC2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ccc(OC)cn1
InChIInChI=1S/C12H19N3O2/c1-4-7-13-12(16)9(2)15-11-6-5-10(17-3)8-14-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyAOLFQNJQZYEIER-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.42
Rot. Bonds6

About 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide

2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide (PubChem CID 106504045) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide
PubChem CID106504045
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ccc(OC)cn1
InChIInChI=1S/C12H19N3O2/c1-4-7-13-12(16)9(2)15-11-6-5-10(17-3)8-14-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyAOLFQNJQZYEIER-UHFFFAOYSA-N
XLogP1.42
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 ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide
CID 61480003
2-[(5-methoxy-2-pyridinyl)amino]propanamide
CID 106503979
methyl 5-[[1-oxo-1-(propylamino)propan-2-yl]amino]pyrazine-2-carboxylate
CID 114059751
2-[(5-methoxy-2-pyridinyl)amino]-N-propylacetamide
CID 106503985
2-(2,4-dimethoxyanilino)-N-propylpropanamide
CID 43087415
5-methoxy-N-propylpyridin-2-amine
CID 106503925
N-hexan-2-yl-5-methoxypyridin-2-amine
CID 103932159
6-[[1-(ethylamino)-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid
CID 54959157
2-[(1-methylpyrazol-3-yl)amino]-N-propylpropanamide
CID 112723457
5-methoxy-N-octan-4-ylpyridin-2-amine
CID 114138454
2-[(6-hydrazinylpyrazin-2-yl)amino]-N-propylpropanamide
CID 80897636
2-(4-butan-2-yloxyanilino)-N-propylpropanamide
CID 3030788

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide?
The IUPAC name of 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide (CID 106504045) is 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide is CCCNC(=O)C(C)Nc1ccc(OC)cn1.
What is the InChIKey of 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide?
The InChIKey is AOLFQNJQZYEIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-4-7-13-12(16)9(2)15-11-6-5-10(17-3)8-14-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,16)(H,14,15).
What are the key properties of 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide?
2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide has a molecular weight of 237.30 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide is sourced from PubChem (CID 106504045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).