2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide

C15H18N4O2 — CID 61357480

IUPAC2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)c1ccncc1N
InChIInChI=1S/C15H18N4O2/c1-19(13-7-8-17-9-11(13)16)10-15(20)18-12-5-3-4-6-14(12)21-2/h3-9H,10,16H2,1-2H3,(H,18,20)
InChIKeyJYUNMYOPJXQWQH-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.75
Rot. Bonds5

About 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide

2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide (PubChem CID 61357480) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide
PubChem CID61357480
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)c1ccncc1N
InChIInChI=1S/C15H18N4O2/c1-19(13-7-8-17-9-11(13)16)10-15(20)18-12-5-3-4-6-14(12)21-2/h3-9H,10,16H2,1-2H3,(H,18,20)
InChIKeyJYUNMYOPJXQWQH-UHFFFAOYSA-N
XLogP1.75
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-amino-4-pyridinyl)sulfanyl]-N-(2-methoxyphenyl)propanamide
CID 43299506
2-[(3-amino-4-pyridinyl)-methylamino]acetic acid
CID 62253485
N-(2-methoxyphenyl)-2-(4-methoxy-N-pyridin-3-ylsulfonylanilino)acetamide
CID 20868473
[2-(2-methoxyanilino)-2-oxoethyl] pyrazine-2-carboxylate
CID 2355502
2-(2-methoxy-N-methylanilino)-N-phenylacetamide
CID 47280952
2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide
CID 18870897
4-hydrazinyl-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 81256164
2-[butyl(methyl)amino]-N-(2-methoxyphenyl)acetamide
CID 109006138
N-(4-amino-2-methoxyphenyl)-2-(N-methylanilino)acetamide
CID 16779548
2-[(2-fluorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
CID 8005528
2-(N-ethylanilino)-N-(2-methoxyphenyl)acetamide
CID 17052689
2-[tert-butyl(methylsulfonyl)amino]-N-(2-methoxyphenyl)acetamide
CID 113152955

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide (CID 61357480) is 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN(C)c1ccncc1N.
What is the InChIKey of 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is JYUNMYOPJXQWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-19(13-7-8-17-9-11(13)16)10-15(20)18-12-5-3-4-6-14(12)21-2/h3-9H,10,16H2,1-2H3,(H,18,20).
What are the key properties of 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide?
2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 286.34 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-pyridinyl)-methylamino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 61357480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).