N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine

C15H17N3 — CID 106565526

IUPACN-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine
SMILESc1ccc(C2CC2n2ccnc2NC2CC2)cc1
InChIInChI=1S/C15H17N3/c1-2-4-11(5-3-1)13-10-14(13)18-9-8-16-15(18)17-12-6-7-12/h1-5,8-9,12-14H,6-7,10H2,(H,16,17)
InChIKeyLNGKRXGZZMPXSQ-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.19
Rot. Bonds4

About N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine

N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine (PubChem CID 106565526) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine
PubChem CID106565526
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC NameN-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine
SMILESc1ccc(C2CC2n2ccnc2NC2CC2)cc1
InChIInChI=1S/C15H17N3/c1-2-4-11(5-3-1)13-10-14(13)18-9-8-16-15(18)17-12-6-7-12/h1-5,8-9,12-14H,6-7,10H2,(H,16,17)
InChIKeyLNGKRXGZZMPXSQ-UHFFFAOYSA-N
XLogP3.19
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine (CID 106565526) is N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine is c1ccc(C2CC2n2ccnc2NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine?
The InChIKey is LNGKRXGZZMPXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-4-11(5-3-1)13-10-14(13)18-9-8-16-15(18)17-12-6-7-12/h1-5,8-9,12-14H,6-7,10H2,(H,16,17).
What are the key properties of N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine?
N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine has a molecular weight of 239.32 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2-phenylcyclopropyl)imidazol-2-amine is sourced from PubChem (CID 106565526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).