1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol

C17H27N3O — CID 95825122

IUPAC1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol
SMILESCC(C)N1CCC[C@@H]1c1cccc(N2CCC(O)CC2)n1
InChIInChI=1S/C17H27N3O/c1-13(2)20-10-4-6-16(20)15-5-3-7-17(18-15)19-11-8-14(21)9-12-19/h3,5,7,13-14,16,21H,4,6,8-12H2,1-2H3/t16-/m1/s1
InChIKeyLNTKWZHKNCZIKS-MRXNPFEDSA-N
MW289.42 g/mol
LogP2.59
Rot. Bonds3

About 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol

1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol (PubChem CID 95825122) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol
PubChem CID95825122
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol
SMILESCC(C)N1CCC[C@@H]1c1cccc(N2CCC(O)CC2)n1
InChIInChI=1S/C17H27N3O/c1-13(2)20-10-4-6-16(20)15-5-3-7-17(18-15)19-11-8-14(21)9-12-19/h3,5,7,13-14,16,21H,4,6,8-12H2,1-2H3/t16-/m1/s1
InChIKeyLNTKWZHKNCZIKS-MRXNPFEDSA-N
XLogP2.59
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
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

2-methyl-3-(1-propan-2-ylpyrrolidin-2-yl)-6-pyrrolidin-1-ylpyridine
CID 102543010
N-methyl-3-[6-(1-propan-2-ylpyrrolidin-2-yl)-2-pyridinyl]propanamide
CID 110269724
2-[(2S)-1-propan-2-ylpyrrolidin-2-yl]-6-(2-propylpyrazol-3-yl)pyridine
CID 125020548
4-[6-methyl-5-(1-propan-2-ylpyrrolidin-2-yl)-2-pyridinyl]morpholine
CID 102543376
2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
CID 89274443
6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 110253678
2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-8-amine
CID 117136485
3-[(2R)-1-propan-2-ylpyrrolidin-2-yl]quinoline
CID 124500180
2-(1-cyclopentylpyrrolidin-2-yl)-6-(2-propan-2-ylimidazol-1-yl)pyridine
CID 110268045
4-[6-methyl-5-[(2R)-1-propan-2-ylpiperidin-2-yl]-2-pyridinyl]morpholine
CID 124500255
3-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,5-a]pyridin-5-ol
CID 117141571
2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine
CID 167249235

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol?
The IUPAC name of 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol (CID 95825122) is 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol.
What is the SMILES notation for 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol?
The canonical SMILES for 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol is CC(C)N1CCC[C@@H]1c1cccc(N2CCC(O)CC2)n1.
What is the InChIKey of 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol?
The InChIKey is LNTKWZHKNCZIKS-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H27N3O/c1-13(2)20-10-4-6-16(20)15-5-3-7-17(18-15)19-11-8-14(21)9-12-19/h3,5,7,13-14,16,21H,4,6,8-12H2,1-2H3/t16-/m1/s1.
What are the key properties of 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol?
1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol has a molecular weight of 289.42 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol is sourced from PubChem (CID 95825122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).