1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone

C10H20N2O2 — CID 103810252

IUPAC1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
SMILESCNCC(=O)N1CCC(C(C)O)CC1
InChIInChI=1S/C10H20N2O2/c1-8(13)9-3-5-12(6-4-9)10(14)7-11-2/h8-9,11,13H,3-7H2,1-2H3
InChIKeyWXKDGVSTYHOLPF-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.17
Rot. Bonds3

About 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone

1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone (PubChem CID 103810252) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone.

Molecular Properties

Compound Name1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
PubChem CID103810252
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
SMILESCNCC(=O)N1CCC(C(C)O)CC1
InChIInChI=1S/C10H20N2O2/c1-8(13)9-3-5-12(6-4-9)10(14)7-11-2/h8-9,11,13H,3-7H2,1-2H3
InChIKeyWXKDGVSTYHOLPF-UHFFFAOYSA-N
XLogP-0.17
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 ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 59542495
1-[(3R)-3-[(1R)-1-hydroxyethyl]piperidin-1-yl]-2-(methylamino)ethanone
CID 129496090
1-[(3R)-3-[(1S)-1-hydroxyethyl]piperidin-1-yl]-2-(methylamino)ethanone
CID 129496088
1-(4-ethylpiperidin-1-yl)-2-(methylamino)ethanone
CID 60963767
2-chloro-1-[4-(1-hydroxyethyl)piperidin-1-yl]ethanone
CID 103881627
1-[4-(1-methoxypropan-2-yl)piperidin-1-yl]-2-(methylamino)ethanone
CID 56881213
4-hydroxy-1-[4-(1-hydroxyethyl)piperidin-1-yl]pentan-1-one
CID 106741495
1-[4-(1-hydroxyethyl)piperidin-1-yl]-3-(propan-2-ylamino)propan-1-one
CID 113264108
bis[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 175316755
1-(4-tert-butylpiperidin-1-yl)-2-(methylamino)ethanone;hydrochloride
CID 119762682
ethyl 1-[2-(methylamino)acetyl]piperidine-4-carboxylate
CID 43086020
2-[4-[(1S)-1-hydroxyethyl]piperidin-1-yl]-2-oxoacetic acid
CID 124680668

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The IUPAC name of 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone (CID 103810252) is 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone.
What is the SMILES notation for 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The canonical SMILES for 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone is CNCC(=O)N1CCC(C(C)O)CC1.
What is the InChIKey of 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The InChIKey is WXKDGVSTYHOLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(13)9-3-5-12(6-4-9)10(14)7-11-2/h8-9,11,13H,3-7H2,1-2H3.
What are the key properties of 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone has a molecular weight of 200.28 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(methylamino)ethanone is sourced from PubChem (CID 103810252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).