5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide

C10H18N6O — CID 106241936

IUPAC5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide
SMILESCc1cnc(NN)nc1NCCCCC(N)=O
InChIInChI=1S/C10H18N6O/c1-7-6-14-10(16-12)15-9(7)13-5-3-2-4-8(11)17/h6H,2-5,12H2,1H3,(H2,11,17)(H2,13,14,15,16)
InChIKeyCOYXNJRAFMYRJH-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.14
Rot. Bonds7

About 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide

5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide (PubChem CID 106241936) has the molecular formula C10H18N6O and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide.

Molecular Properties

Compound Name5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide
PubChem CID106241936
Molecular FormulaC10H18N6O
Molecular Weight238.29 g/mol
Exact Mass238.15
IUPAC Name5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide
SMILESCc1cnc(NN)nc1NCCCCC(N)=O
InChIInChI=1S/C10H18N6O/c1-7-6-14-10(16-12)15-9(7)13-5-3-2-4-8(11)17/h6H,2-5,12H2,1H3,(H2,11,17)(H2,13,14,15,16)
InChIKeyCOYXNJRAFMYRJH-UHFFFAOYSA-N
XLogP0.14
TPSA118.95 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]pentanamide
CID 106241957
3-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80942779
2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine
CID 107819142
5-[[5-bromo-2-(ethylamino)pyrimidin-4-yl]amino]pentanamide
CID 114162870
2-hydrazinyl-5-methyl-N-(4-propan-2-yloxybutyl)pyrimidin-4-amine
CID 106012861
2-hydrazinyl-N-(4-imidazol-1-ylbutyl)-5-methylpyrimidin-4-amine
CID 80903292
2-hydrazinyl-N-(2-methoxyethyl)-5-methylpyrimidin-4-amine
CID 80932366
3-[2-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethylsulfanyl]propan-1-ol
CID 106311885
3-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]-N,2,2-trimethylpropanamide
CID 106280884
2-hydrazinyl-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 80944185
2-hydrazinyl-5-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 80899340
3-[(4,5-dimethylpyrimidin-2-yl)amino]propanamide
CID 131020900

Frequently Asked Questions

What is the IUPAC name of 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide?
The IUPAC name of 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide (CID 106241936) is 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide.
What is the SMILES notation for 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide?
The canonical SMILES for 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide is Cc1cnc(NN)nc1NCCCCC(N)=O.
What is the InChIKey of 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide?
The InChIKey is COYXNJRAFMYRJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O/c1-7-6-14-10(16-12)15-9(7)13-5-3-2-4-8(11)17/h6H,2-5,12H2,1H3,(H2,11,17)(H2,13,14,15,16).
What are the key properties of 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide?
5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide has a molecular weight of 238.29 g/mol, XLogP of 0.14, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentanamide is sourced from PubChem (CID 106241936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).