[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate

C10H18N2O4 — CID 175556728

IUPAC[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate
SMILESCOCC(=O)N1CCC(COC(N)=O)CC1
InChIInChI=1S/C10H18N2O4/c1-15-7-9(13)12-4-2-8(3-5-12)6-16-10(11)14/h8H,2-7H2,1H3,(H2,11,14)
InChIKeySXBIHXHCLUFUDV-UHFFFAOYSA-N
MW230.26 g/mol
LogP-0.03
Rot. Bonds4

About [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate

[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate (PubChem CID 175556728) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate.

Molecular Properties

Compound Name[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate
PubChem CID175556728
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate
SMILESCOCC(=O)N1CCC(COC(N)=O)CC1
InChIInChI=1S/C10H18N2O4/c1-15-7-9(13)12-4-2-8(3-5-12)6-16-10(11)14/h8H,2-7H2,1H3,(H2,11,14)
InChIKeySXBIHXHCLUFUDV-UHFFFAOYSA-N
XLogP-0.03
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(ethylaminomethyl)piperidin-1-yl]-2-methoxyethanone;hydrochloride
CID 119645863
1-[4-(aminooxymethyl)piperidin-1-yl]propan-1-one
CID 39237865
1-[4-[[4-(2-methoxyacetyl)piperazin-1-yl]methyl]piperidin-1-yl]propan-1-one
CID 129178233
2-methoxy-1-[(3S)-3-methylpyrrolidin-1-yl]ethanone
CID 145013525
1-[4-(aminomethyl)piperidin-1-yl]-2-(2-methoxyethoxy)ethanone
CID 103805372
3-amino-1-[4-(methoxymethyl)piperidin-1-yl]butan-1-one
CID 63979201
1-[4-[(5,6-dimethylpyrimidin-4-yl)oxymethyl]piperidin-1-yl]-2-methoxyethanone
CID 134160668
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 60637500
2-(4-aminophenoxy)-1-[4-(methoxymethyl)piperidin-1-yl]ethanone
CID 63971281
2-methoxy-1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone
CID 58139999
1-[4-(methoxymethyl)piperidin-1-yl]-2-(methylamino)ethanone
CID 63977470
2-methoxy-1-[4-(propan-2-ylamino)piperidin-1-yl]ethanone
CID 43747632

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate?
The IUPAC name of [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate (CID 175556728) is [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate.
What is the SMILES notation for [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate?
The canonical SMILES for [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate is COCC(=O)N1CCC(COC(N)=O)CC1.
What is the InChIKey of [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate?
The InChIKey is SXBIHXHCLUFUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-15-7-9(13)12-4-2-8(3-5-12)6-16-10(11)14/h8H,2-7H2,1H3,(H2,11,14).
What are the key properties of [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate?
[1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate has a molecular weight of 230.26 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyacetyl)piperidin-4-yl]methyl carbamate is sourced from PubChem (CID 175556728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).