4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide

C12H23N3O — CID 43711759

IUPAC4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide
SMILESNCCCC(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C12H23N3O/c13-7-1-2-12(16)14-10-5-8-15(9-6-10)11-3-4-11/h10-11H,1-9,13H2,(H,14,16)
InChIKeyNUNWBQJELUNCLT-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.47
Rot. Bonds5

About 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide

4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide (PubChem CID 43711759) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide
PubChem CID43711759
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide
SMILESNCCCC(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C12H23N3O/c13-7-1-2-12(16)14-10-5-8-15(9-6-10)11-3-4-11/h10-11H,1-9,13H2,(H,14,16)
InChIKeyNUNWBQJELUNCLT-UHFFFAOYSA-N
XLogP0.47
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide?
The IUPAC name of 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide (CID 43711759) is 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide.
What is the SMILES notation for 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide?
The canonical SMILES for 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide is NCCCC(=O)NC1CCN(C2CC2)CC1.
What is the InChIKey of 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide?
The InChIKey is NUNWBQJELUNCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c13-7-1-2-12(16)14-10-5-8-15(9-6-10)11-3-4-11/h10-11H,1-9,13H2,(H,14,16).
What are the key properties of 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide?
4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide has a molecular weight of 225.34 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide is sourced from PubChem (CID 43711759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).