(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide

C13H18ClN3O2 — CID 98762896

IUPAC(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide
SMILESC[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@@H](O)C1
InChIInChI=1S/C13H18ClN3O2/c1-9(17-6-2-3-11(18)8-17)13(19)16-12-5-4-10(14)7-15-12/h4-5,7,9,11,18H,2-3,6,8H2,1H3,(H,15,16,19)/t9-,11-/m1/s1
InChIKeyOTFKJOKCYFMJEP-MWLCHTKSSA-N
MW283.76 g/mol
LogP1.52
Rot. Bonds3

About (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide

(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide (PubChem CID 98762896) has the molecular formula C13H18ClN3O2 and a molecular weight of 283.76 g/mol. Its IUPAC name is (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide
PubChem CID98762896
Molecular FormulaC13H18ClN3O2
Molecular Weight283.76 g/mol
Exact Mass283.11
IUPAC Name(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide
SMILESC[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@@H](O)C1
InChIInChI=1S/C13H18ClN3O2/c1-9(17-6-2-3-11(18)8-17)13(19)16-12-5-4-10(14)7-15-12/h4-5,7,9,11,18H,2-3,6,8H2,1H3,(H,15,16,19)/t9-,11-/m1/s1
InChIKeyOTFKJOKCYFMJEP-MWLCHTKSSA-N
XLogP1.52
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-(triazol-2-yl)piperidin-1-yl]propanamide
CID 164584610
(2S)-N-(5-chloro-2-pyridinyl)-2-[(3S)-3-(1-oxidopyridin-1-ium-4-yl)piperidin-1-yl]propanamide
CID 164734825
N-(5-chloro-2-pyridinyl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
CID 110019983
(2S)-N-(5-chloro-2-pyridinyl)-2-(4-fluoropiperidin-1-yl)propanamide
CID 164584586
(2S)-N-(5-chloro-2-pyridinyl)-2-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 95760283
N-(5-chloro-2-pyridinyl)-2-[3-(5-methoxypyrazin-2-yl)piperidin-1-yl]propanamide;ethane
CID 163237865
(3S)-1-[(2S)-1-amino-1-oxopropan-2-yl]-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 94135862
N-(5-chloro-2-pyridinyl)-2-[3-[(1Z)-3-hydroxy-1-(methylamino)buta-1,3-dienyl]piperidin-1-yl]propanamide;propane
CID 164584652
N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]acetamide
CID 94184594
(2S)-N-(5-chloro-2-pyridinyl)-2-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]propanamide
CID 164584521
N-(5-chloro-2-pyridinyl)-1-propan-2-ylpiperidine-3-carboxamide
CID 166193179
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(5-chloro-2-pyridinyl)propanamide;hydrochloride
CID 120775078

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide?
The IUPAC name of (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide (CID 98762896) is (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide?
The canonical SMILES for (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide is C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@@H](O)C1.
What is the InChIKey of (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide?
The InChIKey is OTFKJOKCYFMJEP-MWLCHTKSSA-N. The full InChI is InChI=1S/C13H18ClN3O2/c1-9(17-6-2-3-11(18)8-17)13(19)16-12-5-4-10(14)7-15-12/h4-5,7,9,11,18H,2-3,6,8H2,1H3,(H,15,16,19)/t9-,11-/m1/s1.
What are the key properties of (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide?
(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide has a molecular weight of 283.76 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide is sourced from PubChem (CID 98762896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).