2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine

C18H22N6 — CID 144628437

IUPAC2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine
SMILESCn1c(C2CC2)nc2ccccc21.NNc1ccnc(C2CC2)n1
InChIInChI=1S/C11H12N2.C7H10N4/c1-13-10-5-3-2-4-9(10)12-11(13)8-6-7-8;8-11-6-3-4-9-7(10-6)5-1-2-5/h2-5,8H,6-7H2,1H3;3-5H,1-2,8H2,(H,9,10,11)
InChIKeyLEANRQBMRFVIHA-UHFFFAOYSA-N
MW322.42 g/mol
LogP3.09
Rot. Bonds3

About 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine

2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine (PubChem CID 144628437) has the molecular formula C18H22N6 and a molecular weight of 322.42 g/mol. Its IUPAC name is 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine
PubChem CID144628437
Molecular FormulaC18H22N6
Molecular Weight322.42 g/mol
Exact Mass322.19
IUPAC Name2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine
SMILESCn1c(C2CC2)nc2ccccc21.NNc1ccnc(C2CC2)n1
InChIInChI=1S/C11H12N2.C7H10N4/c1-13-10-5-3-2-4-9(10)12-11(13)8-6-7-8;8-11-6-3-4-9-7(10-6)5-1-2-5/h2-5,8H,6-7H2,1H3;3-5H,1-2,8H2,(H,9,10,11)
InChIKeyLEANRQBMRFVIHA-UHFFFAOYSA-N
XLogP3.09
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.42
LogP ≤ 53.09
H-Bond Donors ≤ 52
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

[2-cyclopropyl-6-[(1R,2R)-2-(1-methylbenzimidazol-2-yl)cyclopropyl]pyrimidin-4-yl]hydrazine
CID 90166375
2-[1-(6-chloro-2-cyclopropylpyrimidin-4-yl)azetidin-3-yl]-1-methylbenzimidazole
CID 89493659
2-cyclopropyl-N-[2-(1-ethylbenzimidazol-2-yl)ethyl]pyrimidin-4-amine
CID 133304089
N-cyclopentyl-1-methylbenzimidazol-2-amine
CID 923815
[2-methoxy-6-[(2R)-2-(1-methylbenzimidazol-2-yl)cyclopropyl]pyrimidin-4-yl]hydrazine
CID 118423207
[2-methoxy-6-[(1R,2R)-2-(1-methylbenzimidazol-2-yl)cyclopropyl]pyrimidin-4-yl]hydrazine
CID 90166372
[2-(2-methylcyclopropyl)pyrimidin-4-yl]hydrazine
CID 65422392
1-methyl-2-[[(3R)-3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methyl]benzimidazole
CID 125023444
6-chloro-2-cyclopropyl-1-methylbenzimidazole
CID 46310330
1-methyl-3-[(1-methylbenzimidazol-2-yl)amino]pyrrolidin-2-one
CID 113341915
2-[3-[[4-(1-methylbenzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]ethanamine
CID 56915361
[3-(1-methylbenzimidazol-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 91947190

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine?
The IUPAC name of 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine (CID 144628437) is 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine?
The canonical SMILES for 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine is Cn1c(C2CC2)nc2ccccc21.NNc1ccnc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine?
The InChIKey is LEANRQBMRFVIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2.C7H10N4/c1-13-10-5-3-2-4-9(10)12-11(13)8-6-7-8;8-11-6-3-4-9-7(10-6)5-1-2-5/h2-5,8H,6-7H2,1H3;3-5H,1-2,8H2,(H,9,10,11).
What are the key properties of 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine?
2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine has a molecular weight of 322.42 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-methylbenzimidazole;(2-cyclopropylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 144628437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).