(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol

C17H27N3O — CID 103938687

IUPAC(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(N2CCN(C3CCCC3)CC2)cn1
InChIInChI=1S/C17H27N3O/c1-2-17(21)16-8-7-15(13-18-16)20-11-9-19(10-12-20)14-5-3-4-6-14/h7-8,13-14,17,21H,2-6,9-12H2,1H3/t17-/m1/s1
InChIKeyKTWVMWBNZIBSBO-QGZVFWFLSA-N
MW289.42 g/mol
LogP2.59
Rot. Bonds4

About (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol

(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol (PubChem CID 103938687) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol
PubChem CID103938687
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(N2CCN(C3CCCC3)CC2)cn1
InChIInChI=1S/C17H27N3O/c1-2-17(21)16-8-7-15(13-18-16)20-11-9-19(10-12-20)14-5-3-4-6-14/h7-8,13-14,17,21H,2-6,9-12H2,1H3/t17-/m1/s1
InChIKeyKTWVMWBNZIBSBO-QGZVFWFLSA-N
XLogP2.59
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585215
(1S)-1-[5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-pyridinyl]propan-1-ol
CID 103938404
(1R)-1-[5-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-pyridinyl]propan-1-ol
CID 113356003
(1R)-1-[5-(4-cyclopropylpiperazin-1-yl)-2-pyridinyl]ethanamine
CID 83122006
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585309
1-[5-(4-butan-2-ylpiperazin-1-yl)-2-pyridinyl]propan-1-ol
CID 115940446
1-[6-[(1S)-1-hydroxypropyl]-3-pyridinyl]-4-methylazepan-4-ol
CID 107405251
(1S)-1-[5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-pyridinyl]ethanol
CID 83131405
(1S)-1-(5-thiomorpholin-4-yl-2-pyridinyl)propan-1-ol
CID 103938335
1-[6-(1-hydroxypropyl)-3-pyridinyl]-4-methylpiperidin-3-ol
CID 102959840
(1S)-1-[5-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-pyridinyl]propan-1-ol
CID 103938701
(1R)-1-[5-(4,4-diethylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 103938741

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol?
The IUPAC name of (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol (CID 103938687) is (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol is CC[C@@H](O)c1ccc(N2CCN(C3CCCC3)CC2)cn1.
What is the InChIKey of (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol?
The InChIKey is KTWVMWBNZIBSBO-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-17(21)16-8-7-15(13-18-16)20-11-9-19(10-12-20)14-5-3-4-6-14/h7-8,13-14,17,21H,2-6,9-12H2,1H3/t17-/m1/s1.
What are the key properties of (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol?
(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol has a molecular weight of 289.42 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 103938687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).