N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine

C7H8N4 — CID 91560703

IUPACN-(1H-pyrrol-2-yl)-1H-imidazol-2-amine
SMILESc1c[nH]c(Nc2ncc[nH]2)c1
InChIInChI=1S/C7H8N4/c1-2-6(8-3-1)11-7-9-4-5-10-7/h1-5,8H,(H2,9,10,11)
InChIKeyIWIISYLWMZVBJE-UHFFFAOYSA-N
MW148.17 g/mol
LogP1.48
Rot. Bonds2

About N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine

N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine (PubChem CID 91560703) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(1H-pyrrol-2-yl)-1H-imidazol-2-amine
PubChem CID91560703
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC NameN-(1H-pyrrol-2-yl)-1H-imidazol-2-amine
SMILESc1c[nH]c(Nc2ncc[nH]2)c1
InChIInChI=1S/C7H8N4/c1-2-6(8-3-1)11-7-9-4-5-10-7/h1-5,8H,(H2,9,10,11)
InChIKeyIWIISYLWMZVBJE-UHFFFAOYSA-N
XLogP1.48
TPSA56.50 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 51.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine?
The IUPAC name of N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine (CID 91560703) is N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine.
What is the SMILES notation for N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine?
The canonical SMILES for N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine is c1c[nH]c(Nc2ncc[nH]2)c1.
What is the InChIKey of N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine?
The InChIKey is IWIISYLWMZVBJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-2-6(8-3-1)11-7-9-4-5-10-7/h1-5,8H,(H2,9,10,11).
What are the key properties of N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine?
N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine has a molecular weight of 148.17 g/mol, XLogP of 1.48, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrrol-2-yl)-1H-imidazol-2-amine is sourced from PubChem (CID 91560703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).