azane;1H-imidazole;1H-pyrrole

C7H12N4 — CID 175573241

IUPACazane;1H-imidazole;1H-pyrrole
SMILESN.c1c[nH]cn1.c1cc[nH]c1
InChIInChI=1S/C4H5N.C3H4N2.H3N/c1-2-4-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H3
InChIKeyUBSLMNPEKZITDG-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.59
Rot. Bonds

About azane;1H-imidazole;1H-pyrrole

azane;1H-imidazole;1H-pyrrole (PubChem CID 175573241) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is azane;1H-imidazole;1H-pyrrole.

Molecular Properties

Compound Nameazane;1H-imidazole;1H-pyrrole
PubChem CID175573241
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Nameazane;1H-imidazole;1H-pyrrole
SMILESN.c1c[nH]cn1.c1cc[nH]c1
InChIInChI=1S/C4H5N.C3H4N2.H3N/c1-2-4-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H3
InChIKeyUBSLMNPEKZITDG-UHFFFAOYSA-N
XLogP1.59
TPSA79.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;1H-imidazole;1H-pyrrole?
The IUPAC name of azane;1H-imidazole;1H-pyrrole (CID 175573241) is azane;1H-imidazole;1H-pyrrole.
What is the SMILES notation for azane;1H-imidazole;1H-pyrrole?
The canonical SMILES for azane;1H-imidazole;1H-pyrrole is N.c1c[nH]cn1.c1cc[nH]c1.
What is the InChIKey of azane;1H-imidazole;1H-pyrrole?
The InChIKey is UBSLMNPEKZITDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N.C3H4N2.H3N/c1-2-4-5-3-1;1-2-5-3-4-1;/h1-5H;1-3H,(H,4,5);1H3.
What are the key properties of azane;1H-imidazole;1H-pyrrole?
azane;1H-imidazole;1H-pyrrole has a molecular weight of 152.20 g/mol, XLogP of 1.59, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1H-imidazole;1H-pyrrole is sourced from PubChem (CID 175573241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).