N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine

C14H25N3 — CID 63106366

IUPACN-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine
SMILESCCn1nc(C)c(CCNC2CCCC2)c1C
InChIInChI=1S/C14H25N3/c1-4-17-12(3)14(11(2)16-17)9-10-15-13-7-5-6-8-13/h13,15H,4-10H2,1-3H3
InChIKeyFWIUMJXAYVCJFI-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.59
Rot. Bonds5

About N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine

N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine (PubChem CID 63106366) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine
PubChem CID63106366
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine
SMILESCCn1nc(C)c(CCNC2CCCC2)c1C
InChIInChI=1S/C14H25N3/c1-4-17-12(3)14(11(2)16-17)9-10-15-13-7-5-6-8-13/h13,15H,4-10H2,1-3H3
InChIKeyFWIUMJXAYVCJFI-UHFFFAOYSA-N
XLogP2.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine (CID 63106366) is N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine is CCn1nc(C)c(CCNC2CCCC2)c1C.
What is the InChIKey of N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine?
The InChIKey is FWIUMJXAYVCJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-17-12(3)14(11(2)16-17)9-10-15-13-7-5-6-8-13/h13,15H,4-10H2,1-3H3.
What are the key properties of N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine?
N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine has a molecular weight of 235.37 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 63106366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).