1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol

C12H19N3O — CID 80823342

IUPAC1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol
SMILESCCCNc1cccc(N2CCC(O)C2)n1
InChIInChI=1S/C12H19N3O/c1-2-7-13-11-4-3-5-12(14-11)15-8-6-10(16)9-15/h3-5,10,16H,2,6-9H2,1H3,(H,13,14)
InChIKeyPGFZSNYCDWBQGG-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.47
Rot. Bonds4

About 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol

1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol (PubChem CID 80823342) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol
PubChem CID80823342
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol
SMILESCCCNc1cccc(N2CCC(O)C2)n1
InChIInChI=1S/C12H19N3O/c1-2-7-13-11-4-3-5-12(14-11)15-8-6-10(16)9-15/h3-5,10,16H,2,6-9H2,1H3,(H,13,14)
InChIKeyPGFZSNYCDWBQGG-UHFFFAOYSA-N
XLogP1.47
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-propylpyridin-2-amine
CID 80789221
6-(3-methylpiperidin-1-yl)-N-propylpyridin-2-amine
CID 80764364
6-(3-ethylpiperidin-1-yl)-N-propylpyridin-2-amine
CID 80793299
1-[2-tert-butyl-6-(propylamino)pyrimidin-4-yl]pyrrolidin-3-ol
CID 80957698
1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide
CID 80754030
6-(4-methylpiperazin-1-yl)-N-propylpyridin-2-amine
CID 80766785
1-[2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]pyrrolidin-3-ol
CID 80957543
(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 103801636
2-[4-[6-(propylamino)-2-pyridinyl]piperazin-1-yl]ethanol
CID 80779096
6-(2,4-dimethylpiperidin-1-yl)-N-propylpyridin-2-amine
CID 80827477
6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-N-propylpyridin-2-amine
CID 82752594
N-propyl-6-pyrazol-1-ylpyridin-2-amine
CID 80853586

Frequently Asked Questions

What is the IUPAC name of 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol?
The IUPAC name of 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol (CID 80823342) is 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol?
The canonical SMILES for 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol is CCCNc1cccc(N2CCC(O)C2)n1.
What is the InChIKey of 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol?
The InChIKey is PGFZSNYCDWBQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-7-13-11-4-3-5-12(14-11)15-8-6-10(16)9-15/h3-5,10,16H,2,6-9H2,1H3,(H,13,14).
What are the key properties of 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol?
1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol has a molecular weight of 221.30 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(propylamino)-2-pyridinyl]pyrrolidin-3-ol is sourced from PubChem (CID 80823342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).