(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol

C15H17ClN2O — CID 94382578

IUPAC(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(Cc2c(Cl)ccc3cccnc23)C1
InChIInChI=1S/C15H17ClN2O/c16-14-6-5-11-3-1-7-17-15(11)13(14)10-18-8-2-4-12(19)9-18/h1,3,5-7,12,19H,2,4,8-10H2/t12-/m1/s1
InChIKeyAPSLGOSPINEBCH-GFCCVEGCSA-N
MW276.77 g/mol
LogP2.84
Rot. Bonds2

About (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol

(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol (PubChem CID 94382578) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol
PubChem CID94382578
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(Cc2c(Cl)ccc3cccnc23)C1
InChIInChI=1S/C15H17ClN2O/c16-14-6-5-11-3-1-7-17-15(11)13(14)10-18-8-2-4-12(19)9-18/h1,3,5-7,12,19H,2,4,8-10H2/t12-/m1/s1
InChIKeyAPSLGOSPINEBCH-GFCCVEGCSA-N
XLogP2.84
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-8-[(4-cyclopentylpiperazin-1-yl)methyl]quinoline
CID 55852939
1-[(2-chloro-6-hydroxyphenyl)methyl]piperidin-3-ol
CID 115879745
2-[4-[(7-chloroquinolin-8-yl)methyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 55831932
1-[(2-chloro-6-fluorophenyl)methyl]piperidin-3-ol
CID 24905047
1-[(2,6-dichloro-4-pyridinyl)methyl]piperidin-3-ol
CID 110904761
(2S)-4-[(7-chloroquinolin-8-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 95278653
4-[(7-chloroquinolin-8-yl)methyl]-2-(3-fluorophenyl)morpholine
CID 86884183
1-[(5-chloropyrazin-2-yl)methyl]piperidin-3-ol
CID 103054140
7-chloro-8-[[4-(oxan-2-ylmethoxy)piperidin-1-yl]methyl]quinoline
CID 102559179
(3S)-1-[(2-chlorophenyl)methyl]piperidin-3-ol
CID 24904413
[1-[(7-chloroquinolin-8-yl)methyl]-3-methylpyrrolidin-3-yl]methanamine
CID 120773381
1-[(3-chloropyrazin-2-yl)methyl]piperidin-3-ol
CID 71649793

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol?
The IUPAC name of (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol (CID 94382578) is (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol.
What is the SMILES notation for (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol?
The canonical SMILES for (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol is O[C@@H]1CCCN(Cc2c(Cl)ccc3cccnc23)C1.
What is the InChIKey of (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol?
The InChIKey is APSLGOSPINEBCH-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H17ClN2O/c16-14-6-5-11-3-1-7-17-15(11)13(14)10-18-8-2-4-12(19)9-18/h1,3,5-7,12,19H,2,4,8-10H2/t12-/m1/s1.
What are the key properties of (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol?
(3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol has a molecular weight of 276.77 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(7-chloroquinolin-8-yl)methyl]piperidin-3-ol is sourced from PubChem (CID 94382578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).