3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide

C11H17N3O2S — CID 86217821

IUPAC3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCC(O)CC1)Nc1nccs1
InChIInChI=1S/C11H17N3O2S/c15-9-1-5-14(6-2-9)7-3-10(16)13-11-12-4-8-17-11/h4,8-9,15H,1-3,5-7H2,(H,12,13,16)
InChIKeyBARGGMYYYFSZGA-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.93
Rot. Bonds4

About 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide

3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 86217821) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
PubChem CID86217821
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCC(O)CC1)Nc1nccs1
InChIInChI=1S/C11H17N3O2S/c15-9-1-5-14(6-2-9)7-3-10(16)13-11-12-4-8-17-11/h4,8-9,15H,1-3,5-7H2,(H,12,13,16)
InChIKeyBARGGMYYYFSZGA-UHFFFAOYSA-N
XLogP0.93
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 78962803
3-(4-acetyl-6-hydroxy-1,4-diazepan-1-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 74239207
3-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-N-(1,3-thiazol-2-yl)propanamide
CID 50975443
N,N'-bis(1,3-thiazol-2-yl)decanediamide
CID 17080102
N-(1,3-thiazol-2-yl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide
CID 171704376
3-(2-phenylmorpholin-4-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 91837781
3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide
CID 124751922
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 81491285
3-piperidin-4-yl-N-(1,3-thiazol-2-yl)propanamide
CID 62212222
3-[(1S,5R)-6-[2-(dimethylamino)-2-oxoethyl]-7-oxo-3,6-diazabicyclo[3.2.2]nonan-3-yl]-N-(1,3-thiazol-2-yl)propanamide
CID 91834587
N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-piperidin-1-ylpropanamide
CID 54640922
2-cyclohexylsulfanyl-N-(1,3-thiazol-2-yl)acetamide
CID 2434094

Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide (CID 86217821) is 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide is O=C(CCN1CCC(O)CC1)Nc1nccs1.
What is the InChIKey of 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is BARGGMYYYFSZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c15-9-1-5-14(6-2-9)7-3-10(16)13-11-12-4-8-17-11/h4,8-9,15H,1-3,5-7H2,(H,12,13,16).
What are the key properties of 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 255.34 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxypiperidin-1-yl)-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 86217821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).