(~15~N_2_)-1H-Imidazole

C3H4N2 — CID 16213375

IUPAC(1,3-15N2)1H-imidazole
SMILESC1=C[15N]=C[15NH]1
InChIInChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/i4+1,5+1
InChIKeyRAXXELZNTBOGNW-MQIHXRCWSA-N
MW70.06 g/mol
LogP-0.10
Rot. Bonds

About (~15~N_2_)-1H-Imidazole

(~15~N_2_)-1H-Imidazole (PubChem CID 16213375) has the molecular formula C3H4N2 and a molecular weight of 70.06 g/mol. Its IUPAC name is (1,3-15N2)1H-imidazole.

Molecular Properties

Compound Name(~15~N_2_)-1H-Imidazole
PubChem CID16213375
Molecular FormulaC3H4N2
Molecular Weight70.06 g/mol
Exact Mass70.03
IUPAC Name(1,3-15N2)1H-imidazole
SMILESC1=C[15N]=C[15NH]1
InChIInChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/i4+1,5+1
InChIKeyRAXXELZNTBOGNW-MQIHXRCWSA-N
XLogP-0.10
TPSA28.70 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity28

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50070.06
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Imidazole
CID 795
2-Nitroimidazole
CID 10701
2-Methylimidazole
CID 12749
1H-Imidazole, 4-bromo-
CID 96125
2-Aminoimidazole
CID 82140
2-Ethylimidazole
CID 66130
2-Bromo-1H-imidazole
CID 2773261
Imidazolium chloride
CID 10197644
4-iodo-1H-imidazole
CID 606522
1-Methyl-1H-imidazol-2-amine
CID 566321
4-Aminoimidazole
CID 484
2-Mercapto-1-methylimidazole
CID 21989623

Frequently Asked Questions

What is the IUPAC name of (~15~N_2_)-1H-Imidazole?
The IUPAC name of (~15~N_2_)-1H-Imidazole (CID 16213375) is (1,3-15N2)1H-imidazole.
What is the SMILES notation for (~15~N_2_)-1H-Imidazole?
The canonical SMILES for (~15~N_2_)-1H-Imidazole is C1=C[15N]=C[15NH]1.
What is the InChIKey of (~15~N_2_)-1H-Imidazole?
The InChIKey is RAXXELZNTBOGNW-MQIHXRCWSA-N. The full InChI is InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/i4+1,5+1.
What are the key properties of (~15~N_2_)-1H-Imidazole?
(~15~N_2_)-1H-Imidazole has a molecular weight of 70.06 g/mol, XLogP of -0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (~15~N_2_)-1H-Imidazole is sourced from PubChem (CID 16213375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).