2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide

C10H14N4O — CID 39178299

IUPAC2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
SMILESC=CCNc1ccc(NC(=O)CN)nc1
InChIInChI=1S/C10H14N4O/c1-2-5-12-8-3-4-9(13-7-8)14-10(15)6-11/h2-4,7,12H,1,5-6,11H2,(H,13,14,15)
InChIKeyJFLDGNZKQUULSD-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.58
Rot. Bonds5

About 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide

2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide (PubChem CID 39178299) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
PubChem CID39178299
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
SMILESC=CCNc1ccc(NC(=O)CN)nc1
InChIInChI=1S/C10H14N4O/c1-2-5-12-8-3-4-9(13-7-8)14-10(15)6-11/h2-4,7,12H,1,5-6,11H2,(H,13,14,15)
InChIKeyJFLDGNZKQUULSD-UHFFFAOYSA-N
XLogP0.58
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluorophenyl)-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
CID 113023878
2-fluoro-N-[5-(prop-2-enylamino)-2-pyridinyl]benzamide
CID 113023833
2-(3-fluorophenyl)-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
CID 113023879
1-cyclohexyl-3-[5-(prop-2-enylamino)-2-pyridinyl]urea
CID 113023884
2-amino-N-[5-(pentylamino)-2-pyridinyl]acetamide
CID 39178282
2-amino-N-[5-(5-hydroxypentylamino)-2-pyridinyl]acetamide
CID 39178424
2-methyl-N-[6-(prop-2-enylamino)-3-pyridinyl]propanamide
CID 113009307
2-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]acetamide
CID 82034084
2-(4-chlorophenyl)-N-[6-(prop-2-enylamino)-3-pyridinyl]acetamide
CID 113009343
2-amino-N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]acetamide
CID 39178469
4-bromo-N-[6-(prop-2-enylamino)-3-pyridinyl]benzamide
CID 113009326
5-N-ethyl-2-N-prop-2-enylpyridine-2,5-diamine
CID 82104360

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide?
The IUPAC name of 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide (CID 39178299) is 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide is C=CCNc1ccc(NC(=O)CN)nc1.
What is the InChIKey of 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide?
The InChIKey is JFLDGNZKQUULSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-2-5-12-8-3-4-9(13-7-8)14-10(15)6-11/h2-4,7,12H,1,5-6,11H2,(H,13,14,15).
What are the key properties of 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide?
2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide has a molecular weight of 206.25 g/mol, XLogP of 0.58, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 39178299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).