1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone

C10H20N2O2 — CID 60841645

IUPAC1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCCC(O)C1
InChIInChI=1S/C10H20N2O2/c1-8(2)11-6-10(14)12-5-3-4-9(13)7-12/h8-9,11,13H,3-7H2,1-2H3
InChIKeyXYLFQFUIVCLGPV-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.03
Rot. Bonds3

About 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone

1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone (PubChem CID 60841645) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone.

Molecular Properties

Compound Name1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone
PubChem CID60841645
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCCC(O)C1
InChIInChI=1S/C10H20N2O2/c1-8(2)11-6-10(14)12-5-3-4-9(13)7-12/h8-9,11,13H,3-7H2,1-2H3
InChIKeyXYLFQFUIVCLGPV-UHFFFAOYSA-N
XLogP-0.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 16745891
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CID 16745892
N-[2-[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-methylpiperidin-1-yl]ethyl]acetamide
CID 44456790
2-(4-(Hydroxymethyl)piperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
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2-[[1-(2-hydroxypropyl)piperidin-4-yl]methyl-methylamino]-N-propan-2-ylacetamide
CID 53616550
5-Acetamido-3,4-piperidinediol
CID 194927
1-(4-Hydroxypiperidin-1-yl)-2-(methylamino)ethan-1-one hydrochloride
CID 45791923
N1-cyclopentyl-N2-(2-hydroxypropyl)oxalamide
CID 44995650
2-(4-hydroxypiperidin-1-yl)-N-(2-methoxyethyl)acetamide
CID 27070086
N-cyclopentyl-2-[4-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 56787484
N-[2-[[(2S)-2-hydroxybutyl]-propan-2-ylamino]ethyl]acetamide
CID 121525553
N-[(1R,2R)-2-hydroxycyclohexyl]-2-[methyl(propan-2-yl)amino]acetamide
CID 137986908

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The IUPAC name of 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone (CID 60841645) is 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone.
What is the SMILES notation for 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The canonical SMILES for 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone is CC(C)NCC(=O)N1CCCC(O)C1.
What is the InChIKey of 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The InChIKey is XYLFQFUIVCLGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(2)11-6-10(14)12-5-3-4-9(13)7-12/h8-9,11,13H,3-7H2,1-2H3.
What are the key properties of 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone has a molecular weight of 200.28 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypiperidin-1-yl)-2-(propan-2-ylamino)ethanone is sourced from PubChem (CID 60841645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).