2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine

C13H19N5 — CID 54881823

IUPAC2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine
SMILESCC(NC1CCCC1n1ccnc1)c1ccn[nH]1
InChIInChI=1S/C13H19N5/c1-10(11-5-6-15-17-11)16-12-3-2-4-13(12)18-8-7-14-9-18/h5-10,12-13,16H,2-4H2,1H3,(H,15,17)
InChIKeyXULUBOLFQXMGQZ-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.05
Rot. Bonds4

About 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine

2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine (PubChem CID 54881823) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine
PubChem CID54881823
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine
SMILESCC(NC1CCCC1n1ccnc1)c1ccn[nH]1
InChIInChI=1S/C13H19N5/c1-10(11-5-6-15-17-11)16-12-3-2-4-13(12)18-8-7-14-9-18/h5-10,12-13,16H,2-4H2,1H3,(H,15,17)
InChIKeyXULUBOLFQXMGQZ-UHFFFAOYSA-N
XLogP2.05
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine (CID 54881823) is 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine is CC(NC1CCCC1n1ccnc1)c1ccn[nH]1.
What is the InChIKey of 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine?
The InChIKey is XULUBOLFQXMGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-10(11-5-6-15-17-11)16-12-3-2-4-13(12)18-8-7-14-9-18/h5-10,12-13,16H,2-4H2,1H3,(H,15,17).
What are the key properties of 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine?
2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine has a molecular weight of 245.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-[1-(1H-pyrazol-5-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 54881823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).