4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide

C13H25N3O2 — CID 66239442

IUPAC4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2COCC2N)CC1
InChIInChI=1S/C13H25N3O2/c1-9(2)16-5-3-10(4-6-16)15-13(17)11-7-18-8-12(11)14/h9-12H,3-8,14H2,1-2H3,(H,15,17)
InChIKeyBDEFWXUWANZDJR-UHFFFAOYSA-N
MW255.36 g/mol
LogP-0.05
Rot. Bonds3

About 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide

4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide (PubChem CID 66239442) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide
PubChem CID66239442
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2COCC2N)CC1
InChIInChI=1S/C13H25N3O2/c1-9(2)16-5-3-10(4-6-16)15-13(17)11-7-18-8-12(11)14/h9-12H,3-8,14H2,1-2H3,(H,15,17)
InChIKeyBDEFWXUWANZDJR-UHFFFAOYSA-N
XLogP-0.05
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide (CID 66239442) is 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide is CC(C)N1CCC(NC(=O)C2COCC2N)CC1.
What is the InChIKey of 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide?
The InChIKey is BDEFWXUWANZDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-9(2)16-5-3-10(4-6-16)15-13(17)11-7-18-8-12(11)14/h9-12H,3-8,14H2,1-2H3,(H,15,17).
What are the key properties of 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide?
4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide has a molecular weight of 255.36 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-propan-2-ylpiperidin-4-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66239442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).