N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide

C11H22N2O2 — CID 106932924

IUPACN-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C[C@H](C)O)CC1
InChIInChI=1S/C11H22N2O2/c1-9(14)8-13-5-3-11(4-6-13)7-12-10(2)15/h9,11,14H,3-8H2,1-2H3,(H,12,15)/t9-/m0/s1
InChIKeyPLYHZTHWBNAJPN-VIFPVBQESA-N
MW214.31 g/mol
LogP0.22
Rot. Bonds4

About N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide

N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide (PubChem CID 106932924) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide
PubChem CID106932924
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C[C@H](C)O)CC1
InChIInChI=1S/C11H22N2O2/c1-9(14)8-13-5-3-11(4-6-13)7-12-10(2)15/h9,11,14H,3-8H2,1-2H3,(H,12,15)/t9-/m0/s1
InChIKeyPLYHZTHWBNAJPN-VIFPVBQESA-N
XLogP0.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(acetamidomethyl)piperidin-1-yl]-2-methylpropanoic acid
CID 102736543
N-[[1-(2,2-dimethoxyethyl)piperidin-4-yl]methyl]acetamide
CID 105346505
N-[(1-ethylpiperidin-4-yl)methyl]acetamide
CID 60968762
N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide
CID 66567390
N-[(1-prop-2-enylpiperidin-4-yl)methyl]acetamide
CID 51116338
N-[[1-(5-oxohexyl)piperidin-4-yl]methyl]acetamide
CID 102736688
N-[[1-(2-piperazin-1-ylethyl)piperidin-4-yl]methyl]acetamide
CID 102736381
N-[[1-[(2S)-2-aminopropanoyl]piperidin-4-yl]methyl]acetamide
CID 66567593
N-[[1-(4-aminobutyl)piperidin-4-yl]methyl]acetamide
CID 102736096
bis(N-[(1-ethylpyrrolidin-3-yl)methyl]acetamide);methane
CID 162144356
N-[[1-(2-ethyl-2-hydroxybutyl)piperidin-4-yl]methyl]acetamide
CID 103931700
N-[[1-(3-methoxy-2-oxopropyl)piperidin-4-yl]methyl]acetamide
CID 107507575

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide (CID 106932924) is N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(C[C@H](C)O)CC1.
What is the InChIKey of N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide?
The InChIKey is PLYHZTHWBNAJPN-VIFPVBQESA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(14)8-13-5-3-11(4-6-13)7-12-10(2)15/h9,11,14H,3-8H2,1-2H3,(H,12,15)/t9-/m0/s1.
What are the key properties of N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide?
N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 106932924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).