N-cyclopentyl-1,3-diethylpyrazol-4-amine

C12H21N3 — CID 69088847

IUPACN-cyclopentyl-1,3-diethylpyrazol-4-amine
SMILESCCc1nn(CC)cc1NC1CCCC1
InChIInChI=1S/C12H21N3/c1-3-11-12(9-15(4-2)14-11)13-10-7-5-6-8-10/h9-10,13H,3-8H2,1-2H3
InChIKeyDWUDCQNWLKYOSS-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.82
Rot. Bonds4

About N-cyclopentyl-1,3-diethylpyrazol-4-amine

N-cyclopentyl-1,3-diethylpyrazol-4-amine (PubChem CID 69088847) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N-cyclopentyl-1,3-diethylpyrazol-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-1,3-diethylpyrazol-4-amine
PubChem CID69088847
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN-cyclopentyl-1,3-diethylpyrazol-4-amine
SMILESCCc1nn(CC)cc1NC1CCCC1
InChIInChI=1S/C12H21N3/c1-3-11-12(9-15(4-2)14-11)13-10-7-5-6-8-10/h9-10,13H,3-8H2,1-2H3
InChIKeyDWUDCQNWLKYOSS-UHFFFAOYSA-N
XLogP2.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1,3-diethylpyrazol-4-amine?
The IUPAC name of N-cyclopentyl-1,3-diethylpyrazol-4-amine (CID 69088847) is N-cyclopentyl-1,3-diethylpyrazol-4-amine.
What is the SMILES notation for N-cyclopentyl-1,3-diethylpyrazol-4-amine?
The canonical SMILES for N-cyclopentyl-1,3-diethylpyrazol-4-amine is CCc1nn(CC)cc1NC1CCCC1.
What is the InChIKey of N-cyclopentyl-1,3-diethylpyrazol-4-amine?
The InChIKey is DWUDCQNWLKYOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-3-11-12(9-15(4-2)14-11)13-10-7-5-6-8-10/h9-10,13H,3-8H2,1-2H3.
What are the key properties of N-cyclopentyl-1,3-diethylpyrazol-4-amine?
N-cyclopentyl-1,3-diethylpyrazol-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1,3-diethylpyrazol-4-amine is sourced from PubChem (CID 69088847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).