2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide

C12H20N4O3 — CID 106234525

IUPAC2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide
SMILESCCCOc1nc(NCCOCC(N)=O)ccc1N
InChIInChI=1S/C12H20N4O3/c1-2-6-19-12-9(13)3-4-11(16-12)15-5-7-18-8-10(14)17/h3-4H,2,5-8,13H2,1H3,(H2,14,17)(H,15,16)
InChIKeyDUBGFBTYBKCDPN-UHFFFAOYSA-N
MW268.32 g/mol
LogP0.37
Rot. Bonds9

About 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide

2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide (PubChem CID 106234525) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide
PubChem CID106234525
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide
SMILESCCCOc1nc(NCCOCC(N)=O)ccc1N
InChIInChI=1S/C12H20N4O3/c1-2-6-19-12-9(13)3-4-11(16-12)15-5-7-18-8-10(14)17/h3-4H,2,5-8,13H2,1H3,(H2,14,17)(H,15,16)
InChIKeyDUBGFBTYBKCDPN-UHFFFAOYSA-N
XLogP0.37
TPSA112.49 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(5-amino-6-methoxy-2-pyridinyl)amino]ethoxy]acetamide
CID 106234342
2-[2-[(5,6-diamino-2-pyridinyl)amino]ethoxy]acetamide
CID 106234451
2-N-(2-but-3-enoxyethyl)-6-propoxypyridine-2,5-diamine
CID 106394409
methyl 2-[(5-amino-6-propoxy-2-pyridinyl)amino]acetate
CID 43261097
2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide
CID 106241754
6-ethoxy-2-N-(2-ethoxyethyl)pyridine-2,5-diamine
CID 43591109
2-N-[3-(diethylamino)propyl]-6-propoxypyridine-2,5-diamine
CID 43261118
2-[2-[(5-amino-6-propoxypyrimidin-4-yl)amino]ethoxy]acetamide
CID 106234455
2-[(5-amino-6-propoxy-2-pyridinyl)amino]propanamide
CID 43545441
2-[2-[(5-bromo-6-methyl-2-pyridinyl)amino]ethoxy]acetamide
CID 106239798
2-N-[3-(dimethylamino)propyl]-6-propoxypyridine-2,5-diamine
CID 43261174
2-[(5-amino-6-propoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide
CID 106334326

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide (CID 106234525) is 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide is CCCOc1nc(NCCOCC(N)=O)ccc1N.
What is the InChIKey of 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide?
The InChIKey is DUBGFBTYBKCDPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-2-6-19-12-9(13)3-4-11(16-12)15-5-7-18-8-10(14)17/h3-4H,2,5-8,13H2,1H3,(H2,14,17)(H,15,16).
What are the key properties of 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide?
2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide has a molecular weight of 268.32 g/mol, XLogP of 0.37, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide is sourced from PubChem (CID 106234525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).