2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide

C10H18N6O — CID 80905733

IUPAC2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1cc(NN)nc(C)n1
InChIInChI=1S/C10H18N6O/c1-3-4-12-10(17)6-13-8-5-9(16-11)15-7(2)14-8/h5H,3-4,6,11H2,1-2H3,(H,12,17)(H2,13,14,15,16)
InChIKeyPOIPYVLZGJBUHI-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.01
Rot. Bonds6

About 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide

2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide (PubChem CID 80905733) has the molecular formula C10H18N6O and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide
PubChem CID80905733
Molecular FormulaC10H18N6O
Molecular Weight238.29 g/mol
Exact Mass238.15
IUPAC Name2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1cc(NN)nc(C)n1
InChIInChI=1S/C10H18N6O/c1-3-4-12-10(17)6-13-8-5-9(16-11)15-7(2)14-8/h5H,3-4,6,11H2,1-2H3,(H,12,17)(H2,13,14,15,16)
InChIKeyPOIPYVLZGJBUHI-UHFFFAOYSA-N
XLogP0.01
TPSA104.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]acetamide
CID 80907084
2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80897487
N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80942500
ethyl 3-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]propanoate
CID 80908084
6-hydrazinyl-2-methyl-N-pentylpyrimidin-4-amine
CID 80932312
2-[[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]ethylurea
CID 83117490
3-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80903463
2-[[6-(ethylamino)pyrazin-2-yl]amino]-N-propylacetamide
CID 78990280
2-[[6-(ethylamino)-2-pyridinyl]amino]-N-propylacetamide
CID 80787440
4-[[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]butanamide
CID 80790862
3-[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]-N-propylpropanamide
CID 80819032
2-[[2-chloro-6-(trifluoromethyl)pyrimidin-4-yl]amino]-N-propylacetamide
CID 114562271

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide?
The IUPAC name of 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide (CID 80905733) is 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide?
The canonical SMILES for 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide is CCCNC(=O)CNc1cc(NN)nc(C)n1.
What is the InChIKey of 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide?
The InChIKey is POIPYVLZGJBUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O/c1-3-4-12-10(17)6-13-8-5-9(16-11)15-7(2)14-8/h5H,3-4,6,11H2,1-2H3,(H,12,17)(H2,13,14,15,16).
What are the key properties of 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide?
2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide has a molecular weight of 238.29 g/mol, XLogP of 0.01, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide is sourced from PubChem (CID 80905733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).