1H-benzimidazole;piperidine

C12H17N3 — CID 66784764

IUPAC1H-benzimidazole;piperidine
SMILESC1CCNCC1.c1ccc2[nH]cnc2c1
InChIInChI=1S/C7H6N2.C5H11N/c1-2-4-7-6(3-1)8-5-9-7;1-2-4-6-5-3-1/h1-5H,(H,8,9);6H,1-5H2
InChIKeyUOUIKYFLNQXAFR-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.32
Rot. Bonds

About 1H-benzimidazole;piperidine

1H-benzimidazole;piperidine (PubChem CID 66784764) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 1H-benzimidazole;piperidine.

Molecular Properties

Compound Name1H-benzimidazole;piperidine
PubChem CID66784764
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name1H-benzimidazole;piperidine
SMILESC1CCNCC1.c1ccc2[nH]cnc2c1
InChIInChI=1S/C7H6N2.C5H11N/c1-2-4-7-6(3-1)8-5-9-7;1-2-4-6-5-3-1/h1-5H,(H,8,9);6H,1-5H2
InChIKeyUOUIKYFLNQXAFR-UHFFFAOYSA-N
XLogP2.32
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-benzimidazole;piperidine?
The IUPAC name of 1H-benzimidazole;piperidine (CID 66784764) is 1H-benzimidazole;piperidine.
What is the SMILES notation for 1H-benzimidazole;piperidine?
The canonical SMILES for 1H-benzimidazole;piperidine is C1CCNCC1.c1ccc2[nH]cnc2c1.
What is the InChIKey of 1H-benzimidazole;piperidine?
The InChIKey is UOUIKYFLNQXAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.C5H11N/c1-2-4-7-6(3-1)8-5-9-7;1-2-4-6-5-3-1/h1-5H,(H,8,9);6H,1-5H2.
What are the key properties of 1H-benzimidazole;piperidine?
1H-benzimidazole;piperidine has a molecular weight of 203.29 g/mol, XLogP of 2.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzimidazole;piperidine is sourced from PubChem (CID 66784764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).