(1-pentylbenzimidazol-2-yl)hydrazine

C12H18N4 — CID 4136867

IUPAC(1-pentylbenzimidazol-2-yl)hydrazine
SMILESCCCCCn1c(NN)nc2ccccc21
InChIInChI=1S/C12H18N4/c1-2-3-6-9-16-11-8-5-4-7-10(11)14-12(16)15-13/h4-5,7-8H,2-3,6,9,13H2,1H3,(H,14,15)
InChIKeyGIHFCKJPXVCLEJ-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.51
Rot. Bonds5

About (1-pentylbenzimidazol-2-yl)hydrazine

(1-pentylbenzimidazol-2-yl)hydrazine (PubChem CID 4136867) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is (1-pentylbenzimidazol-2-yl)hydrazine.

Molecular Properties

Compound Name(1-pentylbenzimidazol-2-yl)hydrazine
PubChem CID4136867
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name(1-pentylbenzimidazol-2-yl)hydrazine
SMILESCCCCCn1c(NN)nc2ccccc21
InChIInChI=1S/C12H18N4/c1-2-3-6-9-16-11-8-5-4-7-10(11)14-12(16)15-13/h4-5,7-8H,2-3,6,9,13H2,1H3,(H,14,15)
InChIKeyGIHFCKJPXVCLEJ-UHFFFAOYSA-N
XLogP2.51
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-[(1-pentylbenzimidazol-2-yl)amino]ethanol
CID 4697809
N-(4-ethoxyphenyl)-1-pentylbenzimidazol-2-amine
CID 4697797
4-N,4-N-diethyl-1-N-(1-pentylbenzimidazol-2-yl)benzene-1,4-diamine
CID 4697855
2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenol
CID 3442786
3-[(1-heptylbenzimidazol-2-yl)amino]propan-1-ol;hydrobromide
CID 2852129
N-(1-octylbenzimidazol-2-yl)benzamide
CID 21449929
1-butyl-N-naphthalen-1-ylbenzimidazol-2-amine
CID 4697787
N-(1-propylbenzimidazol-2-yl)nonanamide
CID 162645010
2-methylsulfanyl-1-pentylbenzimidazole
CID 112774737
2-(2-hydrazinylbenzimidazol-1-yl)acetic acid
CID 2773162
2-tert-butyl-1-pentylbenzimidazole
CID 17000368
2-heptyl-1-nonylbenzimidazole
CID 139787766

Frequently Asked Questions

What is the IUPAC name of (1-pentylbenzimidazol-2-yl)hydrazine?
The IUPAC name of (1-pentylbenzimidazol-2-yl)hydrazine (CID 4136867) is (1-pentylbenzimidazol-2-yl)hydrazine.
What is the SMILES notation for (1-pentylbenzimidazol-2-yl)hydrazine?
The canonical SMILES for (1-pentylbenzimidazol-2-yl)hydrazine is CCCCCn1c(NN)nc2ccccc21.
What is the InChIKey of (1-pentylbenzimidazol-2-yl)hydrazine?
The InChIKey is GIHFCKJPXVCLEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-2-3-6-9-16-11-8-5-4-7-10(11)14-12(16)15-13/h4-5,7-8H,2-3,6,9,13H2,1H3,(H,14,15).
What are the key properties of (1-pentylbenzimidazol-2-yl)hydrazine?
(1-pentylbenzimidazol-2-yl)hydrazine has a molecular weight of 218.30 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pentylbenzimidazol-2-yl)hydrazine is sourced from PubChem (CID 4136867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).