(4-carbamoylpiperidin-1-yl) acetate

C8H14N2O3 — CID 67598253

IUPAC(4-carbamoylpiperidin-1-yl) acetate
SMILESCC(=O)ON1CCC(C(N)=O)CC1
InChIInChI=1S/C8H14N2O3/c1-6(11)13-10-4-2-7(3-5-10)8(9)12/h7H,2-5H2,1H3,(H2,9,12)
InChIKeySUSBQYVHLZMKJE-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.34
Rot. Bonds2

About (4-carbamoylpiperidin-1-yl) acetate

(4-carbamoylpiperidin-1-yl) acetate (PubChem CID 67598253) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is (4-carbamoylpiperidin-1-yl) acetate.

Molecular Properties

Compound Name(4-carbamoylpiperidin-1-yl) acetate
PubChem CID67598253
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name(4-carbamoylpiperidin-1-yl) acetate
SMILESCC(=O)ON1CCC(C(N)=O)CC1
InChIInChI=1S/C8H14N2O3/c1-6(11)13-10-4-2-7(3-5-10)8(9)12/h7H,2-5H2,1H3,(H2,9,12)
InChIKeySUSBQYVHLZMKJE-UHFFFAOYSA-N
XLogP-0.34
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methoxypiperidine-4-carboxamide hydrochloride
CID 72716111
[4-(2-Amino-2-oxoethyl)piperidin-1-yl] 2,2,2-trifluoroacetate
CID 17920893
N-methoxypiperidine-4-carboxamide
CID 49657848
(4-Carbamoylpiperidin-1-yl) 2,2,2-trifluoroacetate
CID 70091753
1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide
CID 155275587
1-Hydroxypiperidine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 159359575
N-methoxy-N-methylpiperidine-4-carboxamide
CID 22405751
Isonipecotamide acetate monohydrate
CID 139080173
N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide
CID 22997352
1-Hydroxypiperidine-4-carboxamide
CID 53697819
N-hydroxy-1-methylpiperidine-4-carboxamide
CID 54232127
1-Methoxypiperidine-4-carboxamide
CID 55280246

Frequently Asked Questions

What is the IUPAC name of (4-carbamoylpiperidin-1-yl) acetate?
The IUPAC name of (4-carbamoylpiperidin-1-yl) acetate (CID 67598253) is (4-carbamoylpiperidin-1-yl) acetate.
What is the SMILES notation for (4-carbamoylpiperidin-1-yl) acetate?
The canonical SMILES for (4-carbamoylpiperidin-1-yl) acetate is CC(=O)ON1CCC(C(N)=O)CC1.
What is the InChIKey of (4-carbamoylpiperidin-1-yl) acetate?
The InChIKey is SUSBQYVHLZMKJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-6(11)13-10-4-2-7(3-5-10)8(9)12/h7H,2-5H2,1H3,(H2,9,12).
What are the key properties of (4-carbamoylpiperidin-1-yl) acetate?
(4-carbamoylpiperidin-1-yl) acetate has a molecular weight of 186.21 g/mol, XLogP of -0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-carbamoylpiperidin-1-yl) acetate is sourced from PubChem (CID 67598253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).