2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide

C13H21N3O2 — CID 54957106

IUPAC2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C13H21N3O2/c1-4-10(5-2)16-12(17)9-14-11-6-7-13(18-3)15-8-11/h6-8,10,14H,4-5,9H2,1-3H3,(H,16,17)
InChIKeyAJMHNGRGANPFEW-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.81
Rot. Bonds7

About 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide

2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide (PubChem CID 54957106) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide
PubChem CID54957106
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C13H21N3O2/c1-4-10(5-2)16-12(17)9-14-11-6-7-13(18-3)15-8-11/h6-8,10,14H,4-5,9H2,1-3H3,(H,16,17)
InChIKeyAJMHNGRGANPFEW-UHFFFAOYSA-N
XLogP1.81
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide
CID 43199045
2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide
CID 54956647
2-(3,4-dichloroanilino)-N-pentan-3-ylacetamide
CID 60671364
(2S)-2-amino-N-(6-methoxy-3-pyridinyl)butanamide
CID 79025042
N-(2-bromoprop-2-enyl)-6-methoxypyridin-3-amine
CID 60873566
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
2-[4-(dimethylamino)anilino]-N-pentan-3-ylacetamide
CID 60685338
2-[(6-methoxy-3-pyridinyl)amino]-2-methylbutanoic acid
CID 114987513
N-(1-hydroxypentan-3-yl)-6-methoxypyridine-3-carboxamide
CID 115767344
2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide
CID 43114026
N-tert-butyl-2-[(6-methoxy-3-pyridinyl)carbamoylamino]acetamide
CID 47139507
2-[(6-methoxy-3-pyridinyl)amino]-2-methylpentanoic acid
CID 114990583

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide?
The IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide (CID 54957106) is 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide?
The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide is CCC(CC)NC(=O)CNc1ccc(OC)nc1.
What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide?
The InChIKey is AJMHNGRGANPFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-4-10(5-2)16-12(17)9-14-11-6-7-13(18-3)15-8-11/h6-8,10,14H,4-5,9H2,1-3H3,(H,16,17).
What are the key properties of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide?
2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide has a molecular weight of 251.33 g/mol, XLogP of 1.81, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide is sourced from PubChem (CID 54957106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).