2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine

C10H15N7 — CID 80896447

IUPAC2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCCn1ccnc1
InChIInChI=1S/C10H15N7/c1-8-6-14-10(16-11)15-9(8)13-3-5-17-4-2-12-7-17/h2,4,6-7H,3,5,11H2,1H3,(H2,13,14,15,16)
InChIKeyYSOQRIMJDYWCHL-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.38
Rot. Bonds5

About 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine

2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine (PubChem CID 80896447) has the molecular formula C10H15N7 and a molecular weight of 233.28 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine
PubChem CID80896447
Molecular FormulaC10H15N7
Molecular Weight233.28 g/mol
Exact Mass233.14
IUPAC Name2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCCn1ccnc1
InChIInChI=1S/C10H15N7/c1-8-6-14-10(16-11)15-9(8)13-3-5-17-4-2-12-7-17/h2,4,6-7H,3,5,11H2,1H3,(H2,13,14,15,16)
InChIKeyYSOQRIMJDYWCHL-UHFFFAOYSA-N
XLogP0.38
TPSA93.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

2-hydrazinyl-N-(4-imidazol-1-ylbutyl)-5-methylpyrimidin-4-amine
CID 80903292
4-[[4-(2-imidazol-1-ylethylamino)-5-methylpyrimidin-2-yl]amino]benzenesulfonamide
CID 68820842
4-N-(3-imidazol-1-ylpropyl)-5-methyl-2-N-propylpyrimidine-2,4-diamine
CID 80753852
2-hydrazinyl-5-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 80899340
2-N-(2-imidazol-1-ylethyl)-5-methylpyridine-2,3-diamine
CID 66280404
3-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80942779
2-hydrazinyl-N-(2-methoxyethyl)-5-methylpyrimidin-4-amine
CID 80932366
4-N-(2-imidazol-1-ylethyl)-5-methylpyrimidine-4,6-diamine
CID 80808824
2-hydrazinyl-5-methyl-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
CID 80898668
2-cyclopropyl-6-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine
CID 80995126
2-hydrazinyl-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 80944185
6-N-ethyl-4-N-(2-imidazol-1-ylethyl)-5-methylpyrimidine-4,6-diamine
CID 80809043

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine (CID 80896447) is 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine is Cc1cnc(NN)nc1NCCn1ccnc1.
What is the InChIKey of 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine?
The InChIKey is YSOQRIMJDYWCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7/c1-8-6-14-10(16-11)15-9(8)13-3-5-17-4-2-12-7-17/h2,4,6-7H,3,5,11H2,1H3,(H2,13,14,15,16).
What are the key properties of 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine?
2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine has a molecular weight of 233.28 g/mol, XLogP of 0.38, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-imidazol-1-ylethyl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80896447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).