N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine

C15H20N4 — CID 106554398

IUPACN-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine
SMILESc1ccc(CCn2ccnc2NC2CCCC2)nc1
InChIInChI=1S/C15H20N4/c1-2-7-14(6-1)18-15-17-10-12-19(15)11-8-13-5-3-4-9-16-13/h3-5,9-10,12,14H,1-2,6-8,11H2,(H,17,18)
InChIKeyVFKSVFACEFZGPF-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.88
Rot. Bonds5

About N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine

N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine (PubChem CID 106554398) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine
PubChem CID106554398
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine
SMILESc1ccc(CCn2ccnc2NC2CCCC2)nc1
InChIInChI=1S/C15H20N4/c1-2-7-14(6-1)18-15-17-10-12-19(15)11-8-13-5-3-4-9-16-13/h3-5,9-10,12,14H,1-2,6-8,11H2,(H,17,18)
InChIKeyVFKSVFACEFZGPF-UHFFFAOYSA-N
XLogP2.88
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine (CID 106554398) is N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine is c1ccc(CCn2ccnc2NC2CCCC2)nc1.
What is the InChIKey of N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine?
The InChIKey is VFKSVFACEFZGPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-7-14(6-1)18-15-17-10-12-19(15)11-8-13-5-3-4-9-16-13/h3-5,9-10,12,14H,1-2,6-8,11H2,(H,17,18).
What are the key properties of N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine?
N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106554398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).