[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine

C15H18N6 — CID 63639635

IUPAC[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
SMILESCCc1c(C)nc(Cc2nc3ccccc3[nH]2)nc1NN
InChIInChI=1S/C15H18N6/c1-3-10-9(2)17-13(20-15(10)21-16)8-14-18-11-6-4-5-7-12(11)19-14/h4-7H,3,8,16H2,1-2H3,(H,18,19)(H,17,20,21)
InChIKeyNETOOHOUEBGPTM-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.10
Rot. Bonds4

About [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine

[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine (PubChem CID 63639635) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
PubChem CID63639635
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
SMILESCCc1c(C)nc(Cc2nc3ccccc3[nH]2)nc1NN
InChIInChI=1S/C15H18N6/c1-3-10-9(2)17-13(20-15(10)21-16)8-14-18-11-6-4-5-7-12(11)19-14/h4-7H,3,8,16H2,1-2H3,(H,18,19)(H,17,20,21)
InChIKeyNETOOHOUEBGPTM-UHFFFAOYSA-N
XLogP2.10
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.10
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'}

Analyze [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(4-chloro-5-ethyl-6-methylpyrimidin-2-yl)methyl]-1H-benzimidazole
CID 63637400
2-(1H-benzimidazol-2-ylmethyl)-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 63638962
[5-ethyl-6-methyl-2-(2-phenylethyl)pyrimidin-4-yl]hydrazine
CID 62250503
[2-(1H-benzimidazol-2-ylmethyl)-6-propylpyrimidin-4-yl]hydrazine
CID 63639636
[2-(1H-benzimidazol-2-ylmethyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 63639806
2-[(4-methylphenyl)methyl]-1H-benzimidazole
CID 772158
2-[(4-chloro-6-methyl-5-propan-2-ylpyrimidin-2-yl)methyl]-1H-benzimidazole
CID 63637567
2-[(4-chloro-6-ethyl-5-iodopyrimidin-2-yl)methyl]-1H-benzimidazole
CID 66294640
bis(2-ethyl-1H-benzimidazole);sulfane
CID 68768079
3-(1H-benzimidazol-2-ylmethyl)-5-ethyl-1,2,4-oxadiazole
CID 16615146
2-[(4,6-dichloropyrimidin-2-yl)methyl]-1H-benzimidazole
CID 63637718
[2-(2,2-dimethylpropyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 63890900

Frequently Asked Questions

What is the IUPAC name of [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine (CID 63639635) is [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine is CCc1c(C)nc(Cc2nc3ccccc3[nH]2)nc1NN.
What is the InChIKey of [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine?
The InChIKey is NETOOHOUEBGPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-3-10-9(2)17-13(20-15(10)21-16)8-14-18-11-6-4-5-7-12(11)19-14/h4-7H,3,8,16H2,1-2H3,(H,18,19)(H,17,20,21).
What are the key properties of [2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine?
[2-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine has a molecular weight of 282.35 g/mol, XLogP of 2.10, 4 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)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63639635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).