1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide

C10H19N3O3 — CID 153399004

IUPAC1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide
SMILESCC(O)C(N)C(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C10H19N3O3/c1-6(14)8(11)10(16)13-4-2-7(3-5-13)9(12)15/h6-8,14H,2-5,11H2,1H3,(H2,12,15)
InChIKeyYUWLRQQLKMKRSR-UHFFFAOYSA-N
MW229.28 g/mol
LogP-1.58
Rot. Bonds3

About 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide

1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide (PubChem CID 153399004) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide
PubChem CID153399004
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide
SMILESCC(O)C(N)C(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C10H19N3O3/c1-6(14)8(11)10(16)13-4-2-7(3-5-13)9(12)15/h6-8,14H,2-5,11H2,1H3,(H2,12,15)
InChIKeyYUWLRQQLKMKRSR-UHFFFAOYSA-N
XLogP-1.58
TPSA109.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-1.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide (CID 153399004) is 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide is CC(O)C(N)C(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide?
The InChIKey is YUWLRQQLKMKRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-6(14)8(11)10(16)13-4-2-7(3-5-13)9(12)15/h6-8,14H,2-5,11H2,1H3,(H2,12,15).
What are the key properties of 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide?
1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide has a molecular weight of 229.28 g/mol, XLogP of -1.58, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-hydroxybutanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 153399004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).