2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide

C12H23N3O3 — CID 51243863

IUPAC2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide
SMILESCC(C)NC(=O)NC(=O)C(C)N1CCC(O)CC1
InChIInChI=1S/C12H23N3O3/c1-8(2)13-12(18)14-11(17)9(3)15-6-4-10(16)5-7-15/h8-10,16H,4-7H2,1-3H3,(H2,13,14,17,18)
InChIKeyZZPJPXRNBRDTLN-UHFFFAOYSA-N
MW257.33 g/mol
LogP0.07
Rot. Bonds3

About 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide

2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide (PubChem CID 51243863) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide
PubChem CID51243863
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide
SMILESCC(C)NC(=O)NC(=O)C(C)N1CCC(O)CC1
InChIInChI=1S/C12H23N3O3/c1-8(2)13-12(18)14-11(17)9(3)15-6-4-10(16)5-7-15/h8-10,16H,4-7H2,1-3H3,(H2,13,14,17,18)
InChIKeyZZPJPXRNBRDTLN-UHFFFAOYSA-N
XLogP0.07
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide?
The IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide (CID 51243863) is 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide.
What is the SMILES notation for 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide?
The canonical SMILES for 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide is CC(C)NC(=O)NC(=O)C(C)N1CCC(O)CC1.
What is the InChIKey of 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide?
The InChIKey is ZZPJPXRNBRDTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-8(2)13-12(18)14-11(17)9(3)15-6-4-10(16)5-7-15/h8-10,16H,4-7H2,1-3H3,(H2,13,14,17,18).
What are the key properties of 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide?
2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide has a molecular weight of 257.33 g/mol, XLogP of 0.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxypiperidin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide is sourced from PubChem (CID 51243863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).