1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol

C15H24N2O — CID 112585280

IUPAC1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(N(CC)C2CCCC2)cn1
InChIInChI=1S/C15H24N2O/c1-3-15(18)14-10-9-13(11-16-14)17(4-2)12-7-5-6-8-12/h9-12,15,18H,3-8H2,1-2H3
InChIKeyINXNWBFGERAVSA-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.29
Rot. Bonds5

About 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol

1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol (PubChem CID 112585280) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol
PubChem CID112585280
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(N(CC)C2CCCC2)cn1
InChIInChI=1S/C15H24N2O/c1-3-15(18)14-10-9-13(11-16-14)17(4-2)12-7-5-6-8-12/h9-12,15,18H,3-8H2,1-2H3
InChIKeyINXNWBFGERAVSA-UHFFFAOYSA-N
XLogP3.29
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[5-[cyclopentyl(3-methylbutyl)amino]-2-pyridinyl]propan-1-ol
CID 103938891
1-[5-[cycloheptyl(methyl)amino]-2-pyridinyl]propan-1-ol
CID 112585300
6-(1-aminopropyl)-N-cyclopentyl-N-ethylpyridin-3-amine
CID 112584188
(1S)-1-[5-[cyclopropyl(2-hydroxyethyl)amino]-2-pyridinyl]propan-1-ol
CID 103938569
(1R)-1-[5-[cyclopropyl(2-methylpropyl)amino]-2-pyridinyl]propan-1-ol
CID 113355348
(1R)-1-[5-[cyclopropyl(methyl)amino]-2-pyridinyl]propan-1-ol
CID 103938348
6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine
CID 103936962
3-[cyclopropyl-[6-[(1S)-1-hydroxypropyl]-3-pyridinyl]amino]propanenitrile
CID 103938579
(1S)-1-[5-[cyclobutylmethyl(methyl)amino]-2-pyridinyl]propan-1-ol
CID 103938697
(1R)-1-[5-[cyclopentyl(2-hydroxyethyl)amino]-2-pyridinyl]ethanol
CID 83132145
(1R)-1-[5-[cyclopropylmethyl(ethyl)amino]-2-pyridinyl]propan-1-ol
CID 113355380
(1S)-1-[5-[methyl-(1-methylpiperidin-4-yl)amino]-2-pyridinyl]propan-1-ol
CID 103938300

Frequently Asked Questions

What is the IUPAC name of 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol?
The IUPAC name of 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol (CID 112585280) is 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol?
The canonical SMILES for 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol is CCC(O)c1ccc(N(CC)C2CCCC2)cn1.
What is the InChIKey of 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol?
The InChIKey is INXNWBFGERAVSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-15(18)14-10-9-13(11-16-14)17(4-2)12-7-5-6-8-12/h9-12,15,18H,3-8H2,1-2H3.
What are the key properties of 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol?
1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 112585280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).