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

C14H23N3O2 — CID 43114026

IUPAC2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)Nc1ccc(OC)nc1
InChIInChI=1S/C14H23N3O2/c1-4-5-6-9-15-14(18)11(2)17-12-7-8-13(19-3)16-10-12/h7-8,10-11,17H,4-6,9H2,1-3H3,(H,15,18)
InChIKeyWGPCLKNJVIURGV-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.20
Rot. Bonds8

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

2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide (PubChem CID 43114026) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide.

Molecular Properties

Compound Name2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide
PubChem CID43114026
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)Nc1ccc(OC)nc1
InChIInChI=1S/C14H23N3O2/c1-4-5-6-9-15-14(18)11(2)17-12-7-8-13(19-3)16-10-12/h7-8,10-11,17H,4-6,9H2,1-3H3,(H,15,18)
InChIKeyWGPCLKNJVIURGV-UHFFFAOYSA-N
XLogP2.20
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(6-methoxy-3-pyridinyl)amino]-N-prop-2-ynylpropanamide
CID 43114033
(2R)-N-(ethylcarbamoyl)-2-[(6-methoxy-3-pyridinyl)amino]propanamide
CID 28888999
2-[4-(2-methoxyphenoxy)anilino]-N-pentylpropanamide
CID 134039373
2-(3-fluoro-4-methoxyanilino)-N-pentylpropanamide
CID 43380763
2-(3-chloro-4-methoxyanilino)-N-pentylpropanamide
CID 43113186
2-(3-bromo-4-methoxyanilino)-N-pentylpropanamide
CID 63996831
N,N-diethyl-2-[(6-methoxy-3-pyridinyl)amino]propanamide
CID 43114034
(2R)-N-(3,5-dimethoxyphenyl)-2-[(6-methoxy-3-pyridinyl)amino]propanamide
CID 25345790
2-[(6-methoxy-3-pyridinyl)amino]-N-(propan-2-ylcarbamoyl)propanamide
CID 47023248
2-(3-bromo-5-methoxyanilino)-N-pentylpropanamide
CID 82867453
ethyl N-[4-[[1-oxo-1-(pentylamino)propan-2-yl]amino]phenyl]carbamate
CID 60542297
N-butyl-2-(4-propoxyanilino)propanamide
CID 62329025

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide?
The IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide (CID 43114026) is 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide.
What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide?
The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide is CCCCCNC(=O)C(C)Nc1ccc(OC)nc1.
What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide?
The InChIKey is WGPCLKNJVIURGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-4-5-6-9-15-14(18)11(2)17-12-7-8-13(19-3)16-10-12/h7-8,10-11,17H,4-6,9H2,1-3H3,(H,15,18).
What are the key properties of 2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide?
2-[(6-methoxy-3-pyridinyl)amino]-N-pentylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 2.20, 8 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-pentylpropanamide is sourced from PubChem (CID 43114026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).