2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide

C12H21N3O3 — CID 64891161

IUPAC2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(C(=O)C2(N)CCOC2)CC1
InChIInChI=1S/C12H21N3O3/c13-10(16)7-9-1-4-15(5-2-9)11(17)12(14)3-6-18-8-12/h9H,1-8,14H2,(H2,13,16)
InChIKeyVQUJBOFTXDLAQG-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.78
Rot. Bonds3

About 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide

2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide (PubChem CID 64891161) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide
PubChem CID64891161
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(C(=O)C2(N)CCOC2)CC1
InChIInChI=1S/C12H21N3O3/c13-10(16)7-9-1-4-15(5-2-9)11(17)12(14)3-6-18-8-12/h9H,1-8,14H2,(H2,13,16)
InChIKeyVQUJBOFTXDLAQG-UHFFFAOYSA-N
XLogP-0.78
TPSA98.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3-aminooxolan-3-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
CID 64892612
(3-aminooxolan-3-yl)-(4-methylpiperidin-1-yl)methanone
CID 64891679
1-(3-aminooxolane-3-carbonyl)piperidine-4-carboxylic acid
CID 64891574
(3-aminooxolan-3-yl)-[4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]methanone
CID 64891765
N-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]ethanesulfonamide
CID 64893796
(4-aminooxan-4-yl)-(4-methylpiperidin-1-yl)methanone
CID 115293431
2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide
CID 62782565
(4-aminooxan-4-yl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 115294424
[4-(4-aminooxane-4-carbonyl)piperazin-1-yl]-cyclopropylmethanone
CID 115294224
1-(3-aminooxolane-3-carbonyl)-3-methylpiperidine-3-carboxylic acid
CID 64893003
(3S)-3-aminooxolane-3-carboxamide
CID 96640573
4-[4-(2-amino-2-oxoethyl)piperidin-1-yl]-4-oxobutanoic acid
CID 54876368

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide (CID 64891161) is 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide is NC(=O)CC1CCN(C(=O)C2(N)CCOC2)CC1.
What is the InChIKey of 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide?
The InChIKey is VQUJBOFTXDLAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c13-10(16)7-9-1-4-15(5-2-9)11(17)12(14)3-6-18-8-12/h9H,1-8,14H2,(H2,13,16).
What are the key properties of 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide?
2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide has a molecular weight of 255.32 g/mol, XLogP of -0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-aminooxolane-3-carbonyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 64891161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).