(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone

C15H21N3O2 — CID 63851017

IUPAC(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
SMILESO=C(c1cncc(O)c1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C15H21N3O2/c19-13-7-12(8-16-9-13)15(20)18-6-2-3-11(10-18)14-4-1-5-17-14/h7-9,11,14,17,19H,1-6,10H2
InChIKeyGKMJFUFTYJVPDQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.39
Rot. Bonds2

About (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone

(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone (PubChem CID 63851017) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
PubChem CID63851017
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
SMILESO=C(c1cncc(O)c1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C15H21N3O2/c19-13-7-12(8-16-9-13)15(20)18-6-2-3-11(10-18)14-4-1-5-17-14/h7-9,11,14,17,19H,1-6,10H2
InChIKeyGKMJFUFTYJVPDQ-UHFFFAOYSA-N
XLogP1.39
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3,5-dimethylphenyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 60979101
(5-methyl-3-pyridinyl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119999315
(5-bromothiophen-3-yl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 103832103
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-(5-hydroxy-3-pyridinyl)methanone
CID 63860883
(2-hydroxyphenyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 60978290
(3-pyrrolidin-2-ylpiperidin-1-yl)-(1,2,5-thiadiazol-3-yl)methanone
CID 54886047
3,9-diazabicyclo[4.2.1]nonan-3-yl-(5-hydroxy-3-pyridinyl)methanone
CID 115313946
(2,5-dichlorophenyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 60978829
[(1R,5S)-8-amino-3-azabicyclo[3.2.1]octan-3-yl]-(5-hydroxy-3-pyridinyl)methanone;dihydrochloride
CID 154907415
(4-hydroxyphenyl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 63259419
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(5-hydroxy-3-pyridinyl)methanone
CID 78954237
[(5aS,9aR)-1,2,3,4,5,5a,6,8,9,9a-decahydropyrido[4,3-b]azepin-7-yl]-(6-methyl-3-pyridinyl)methanone
CID 110124578

Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The IUPAC name of (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone (CID 63851017) is (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone is O=C(c1cncc(O)c1)N1CCCC(C2CCCN2)C1.
What is the InChIKey of (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The InChIKey is GKMJFUFTYJVPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c19-13-7-12(8-16-9-13)15(20)18-6-2-3-11(10-18)14-4-1-5-17-14/h7-9,11,14,17,19H,1-6,10H2.
What are the key properties of (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
(5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone has a molecular weight of 275.35 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-3-pyridinyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 63851017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).