1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide

C12H21N3O3 — CID 66240807

IUPAC1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)C2COCC2N)CC1
InChIInChI=1S/C12H21N3O3/c1-14-11(16)8-2-4-15(5-3-8)12(17)9-6-18-7-10(9)13/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyFKOOWBFXIPFKSQ-UHFFFAOYSA-N
MW255.32 g/mol
LogP-1.06
Rot. Bonds2

About 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide

1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide (PubChem CID 66240807) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide
PubChem CID66240807
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)C2COCC2N)CC1
InChIInChI=1S/C12H21N3O3/c1-14-11(16)8-2-4-15(5-3-8)12(17)9-6-18-7-10(9)13/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyFKOOWBFXIPFKSQ-UHFFFAOYSA-N
XLogP-1.06
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide (CID 66240807) is 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(C(=O)C2COCC2N)CC1.
What is the InChIKey of 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is FKOOWBFXIPFKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-14-11(16)8-2-4-15(5-3-8)12(17)9-6-18-7-10(9)13/h8-10H,2-7,13H2,1H3,(H,14,16).
What are the key properties of 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide?
1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 255.32 g/mol, XLogP of -1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 66240807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).