N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide

C14H22N2O3 — CID 131896134

IUPACN-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide
SMILESO=C(NCC1CCN(C(=O)CO)CC1)C1CC12CC2
InChIInChI=1S/C14H22N2O3/c17-9-12(18)16-5-1-10(2-6-16)8-15-13(19)11-7-14(11)3-4-14/h10-11,17H,1-9H2,(H,15,19)
InChIKeyRGPRBOLLDAKSJC-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.13
Rot. Bonds4

About N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide

N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide (PubChem CID 131896134) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide
PubChem CID131896134
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide
SMILESO=C(NCC1CCN(C(=O)CO)CC1)C1CC12CC2
InChIInChI=1S/C14H22N2O3/c17-9-12(18)16-5-1-10(2-6-16)8-15-13(19)11-7-14(11)3-4-14/h10-11,17H,1-9H2,(H,15,19)
InChIKeyRGPRBOLLDAKSJC-UHFFFAOYSA-N
XLogP0.13
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide?
The IUPAC name of N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide (CID 131896134) is N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide.
What is the SMILES notation for N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide?
The canonical SMILES for N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide is O=C(NCC1CCN(C(=O)CO)CC1)C1CC12CC2.
What is the InChIKey of N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide?
The InChIKey is RGPRBOLLDAKSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c17-9-12(18)16-5-1-10(2-6-16)8-15-13(19)11-7-14(11)3-4-14/h10-11,17H,1-9H2,(H,15,19).
What are the key properties of N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide?
N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-hydroxyacetyl)piperidin-4-yl]methyl]spiro[2.2]pentane-2-carboxamide is sourced from PubChem (CID 131896134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).