N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide

C10H15N5 — CID 121358419

IUPACN'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide
SMILES[H]/N=C(/N=C(\N)N1CC=CC1)N1CC=CC1
InChIInChI=1S/C10H15N5/c11-9(14-5-1-2-6-14)13-10(12)15-7-3-4-8-15/h1-4H,5-8H2,(H3,11,12,13)
InChIKeyLICQXGKKVOXYAW-UHFFFAOYSA-N
MW205.27 g/mol
LogP-0.02
Rot. Bonds

About N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide

N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide (PubChem CID 121358419) has the molecular formula C10H15N5 and a molecular weight of 205.27 g/mol. Its IUPAC name is N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide.

Molecular Properties

Compound NameN'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide
PubChem CID121358419
Molecular FormulaC10H15N5
Molecular Weight205.27 g/mol
Exact Mass205.13
IUPAC NameN'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide
SMILES[H]/N=C(/N=C(\N)N1CC=CC1)N1CC=CC1
InChIInChI=1S/C10H15N5/c11-9(14-5-1-2-6-14)13-10(12)15-7-3-4-8-15/h1-4H,5-8H2,(H3,11,12,13)
InChIKeyLICQXGKKVOXYAW-UHFFFAOYSA-N
XLogP-0.02
TPSA68.71 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide?
The IUPAC name of N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide (CID 121358419) is N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide.
What is the SMILES notation for N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide?
The canonical SMILES for N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide is [H]/N=C(/N=C(\N)N1CC=CC1)N1CC=CC1.
What is the InChIKey of N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide?
The InChIKey is LICQXGKKVOXYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c11-9(14-5-1-2-6-14)13-10(12)15-7-3-4-8-15/h1-4H,5-8H2,(H3,11,12,13).
What are the key properties of N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide?
N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide has a molecular weight of 205.27 g/mol, XLogP of -0.02, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,5-dihydropyrrole-1-carboximidoyl)-2,5-dihydropyrrole-1-carboximidamide is sourced from PubChem (CID 121358419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).