[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine

C11H14N4 — CID 116882113

IUPAC[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine
SMILESNCC1(c2ncc(-c3ccc[nH]3)[nH]2)CC1
InChIInChI=1S/C11H14N4/c12-7-11(3-4-11)10-14-6-9(15-10)8-2-1-5-13-8/h1-2,5-6,13H,3-4,7,12H2,(H,14,15)
InChIKeyICKPTRJMBFIOFC-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.40
Rot. Bonds3

About [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine

[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine (PubChem CID 116882113) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine
PubChem CID116882113
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine
SMILESNCC1(c2ncc(-c3ccc[nH]3)[nH]2)CC1
InChIInChI=1S/C11H14N4/c12-7-11(3-4-11)10-14-6-9(15-10)8-2-1-5-13-8/h1-2,5-6,13H,3-4,7,12H2,(H,14,15)
InChIKeyICKPTRJMBFIOFC-UHFFFAOYSA-N
XLogP1.40
TPSA70.49 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine?
The IUPAC name of [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine (CID 116882113) is [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine?
The canonical SMILES for [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine is NCC1(c2ncc(-c3ccc[nH]3)[nH]2)CC1.
What is the InChIKey of [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine?
The InChIKey is ICKPTRJMBFIOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c12-7-11(3-4-11)10-14-6-9(15-10)8-2-1-5-13-8/h1-2,5-6,13H,3-4,7,12H2,(H,14,15).
What are the key properties of [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine?
[1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine has a molecular weight of 202.26 g/mol, XLogP of 1.40, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[5-(1H-pyrrol-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine is sourced from PubChem (CID 116882113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).