[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine

C15H18N6 — CID 63639636

IUPAC[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1cc(NN)nc(Cc2nc3ccccc3[nH]2)n1
InChIInChI=1S/C15H18N6/c1-2-5-10-8-15(21-16)20-13(17-10)9-14-18-11-6-3-4-7-12(11)19-14/h3-4,6-8H,2,5,9,16H2,1H3,(H,18,19)(H,17,20,21)
InChIKeyJZPDGWMJDYDORX-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.18
Rot. Bonds5

About [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine

[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine (PubChem CID 63639636) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine
PubChem CID63639636
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1cc(NN)nc(Cc2nc3ccccc3[nH]2)n1
InChIInChI=1S/C15H18N6/c1-2-5-10-8-15(21-16)20-13(17-10)9-14-18-11-6-3-4-7-12(11)19-14/h3-4,6-8H,2,5,9,16H2,1H3,(H,18,19)(H,17,20,21)
InChIKeyJZPDGWMJDYDORX-UHFFFAOYSA-N
XLogP2.18
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-(1H-benzimidazol-2-ylmethyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 63639806
2-(1H-benzimidazol-2-ylmethyl)-6-cyclopropyl-N-methylpyrimidin-4-amine
CID 63639303
[2-[(3,5-dimethylphenyl)methyl]-6-propylpyrimidin-4-yl]hydrazine
CID 62594083
[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 63639635
[2-(phenoxymethyl)-6-propylpyrimidin-4-yl]hydrazine
CID 62717068
2-[(4,6-dichloropyrimidin-2-yl)methyl]-1H-benzimidazole
CID 63637718
2-(1H-benzimidazol-2-ylmethyl)-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 63638962
1H-benzimidazol-2-ylmethanamine;hydrate
CID 23192500
2-[[4-chloro-6-(methoxymethyl)pyrimidin-2-yl]methyl]-1H-benzimidazole
CID 63637402
2-benzyl-N-ethyl-6-propylpyrimidin-4-amine
CID 62192157
[2-(butan-2-ylsulfanylmethyl)-6-propylpyrimidin-4-yl]hydrazine
CID 65141294
2-[(4-methylphenyl)methyl]-1H-benzimidazole
CID 772158

Frequently Asked Questions

What is the IUPAC name of [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine (CID 63639636) is [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine is CCCc1cc(NN)nc(Cc2nc3ccccc3[nH]2)n1.
What is the InChIKey of [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine?
The InChIKey is JZPDGWMJDYDORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-2-5-10-8-15(21-16)20-13(17-10)9-14-18-11-6-3-4-7-12(11)19-14/h3-4,6-8H,2,5,9,16H2,1H3,(H,18,19)(H,17,20,21).
What are the key properties of [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine?
[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine has a molecular weight of 282.35 g/mol, XLogP of 2.18, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63639636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).