1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine

C14H21N3 — CID 171287680

IUPAC1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine
SMILESc1cncc([C@@H](CC2CC2)N2CCNCC2)c1
InChIInChI=1S/C14H21N3/c1-2-13(11-16-5-1)14(10-12-3-4-12)17-8-6-15-7-9-17/h1-2,5,11-12,14-15H,3-4,6-10H2/t14-/m1/s1
InChIKeyVZDWXICNQVDDLW-CQSZACIVSA-N
MW231.34 g/mol
LogP1.83
Rot. Bonds4

About 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine

1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine (PubChem CID 171287680) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine
PubChem CID171287680
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine
SMILESc1cncc([C@@H](CC2CC2)N2CCNCC2)c1
InChIInChI=1S/C14H21N3/c1-2-13(11-16-5-1)14(10-12-3-4-12)17-8-6-15-7-9-17/h1-2,5,11-12,14-15H,3-4,6-10H2/t14-/m1/s1
InChIKeyVZDWXICNQVDDLW-CQSZACIVSA-N
XLogP1.83
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1S)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine;dihydrochloride
CID 171275053
1-[(1S)-1-pyridin-3-ylpropyl]piperazine
CID 92764058
1-(2-piperazin-1-yl-2-pyridin-3-ylethyl)piperidin-4-ol
CID 83978977
1-[(1S)-1-(6-chloro-3-pyridinyl)-2-cyclopropylethyl]piperazine
CID 171276536
1-[(1S)-1-pyridin-3-ylpentyl]piperazine
CID 171308841
1-[(R)-cyclopentyl(pyridin-3-yl)methyl]piperazine;dihydrochloride
CID 171287672
1-[(1R)-2-cyclopropyl-1-(4-iodophenyl)ethyl]piperazine
CID 171288681
1-[(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethyl]piperazine
CID 171292165
1-(2-piperazin-1-yl-1-pyridin-3-ylethyl)azepane
CID 82201767
1-[(1R)-2-cyclopropyl-1-(4-iodophenyl)ethyl]piperazine;dihydrochloride
CID 171288682
1-[(1S)-2-cyclopropyl-1-(4-fluorophenyl)ethyl]piperazine;dihydrochloride
CID 171273249
1-[(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethyl]piperazine;dihydrochloride
CID 171292166

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine?
The IUPAC name of 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine (CID 171287680) is 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine.
What is the SMILES notation for 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine?
The canonical SMILES for 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine is c1cncc([C@@H](CC2CC2)N2CCNCC2)c1.
What is the InChIKey of 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine?
The InChIKey is VZDWXICNQVDDLW-CQSZACIVSA-N. The full InChI is InChI=1S/C14H21N3/c1-2-13(11-16-5-1)14(10-12-3-4-12)17-8-6-15-7-9-17/h1-2,5,11-12,14-15H,3-4,6-10H2/t14-/m1/s1.
What are the key properties of 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine?
1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine has a molecular weight of 231.34 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-cyclopropyl-1-pyridin-3-ylethyl]piperazine is sourced from PubChem (CID 171287680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).