1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine

C14H20FN5 — CID 122169226

IUPAC1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine
SMILESCCn1ncc(CNc2cnn(C3CCCC3)c2)c1F
InChIInChI=1S/C14H20FN5/c1-2-19-14(15)11(8-17-19)7-16-12-9-18-20(10-12)13-5-3-4-6-13/h8-10,13,16H,2-7H2,1H3
InChIKeyHVNLJRPOCABLDY-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.97
Rot. Bonds5

About 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine

1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine (PubChem CID 122169226) has the molecular formula C14H20FN5 and a molecular weight of 277.35 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine
PubChem CID122169226
Molecular FormulaC14H20FN5
Molecular Weight277.35 g/mol
Exact Mass277.17
IUPAC Name1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine
SMILESCCn1ncc(CNc2cnn(C3CCCC3)c2)c1F
InChIInChI=1S/C14H20FN5/c1-2-19-14(15)11(8-17-19)7-16-12-9-18-20(10-12)13-5-3-4-6-13/h8-10,13,16H,2-7H2,1H3
InChIKeyHVNLJRPOCABLDY-UHFFFAOYSA-N
XLogP2.97
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine 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-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine?
The IUPAC name of 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine (CID 122169226) is 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine?
The canonical SMILES for 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine is CCn1ncc(CNc2cnn(C3CCCC3)c2)c1F.
What is the InChIKey of 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine?
The InChIKey is HVNLJRPOCABLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN5/c1-2-19-14(15)11(8-17-19)7-16-12-9-18-20(10-12)13-5-3-4-6-13/h8-10,13,16H,2-7H2,1H3.
What are the key properties of 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine?
1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine has a molecular weight of 277.35 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(1-ethyl-5-fluoropyrazol-4-yl)methyl]pyrazol-4-amine is sourced from PubChem (CID 122169226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).