3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid

C10H18N2O4 — CID 62670284

IUPAC3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid
SMILESCC(CNC(=O)N1CCC(O)CC1)C(=O)O
InChIInChI=1S/C10H18N2O4/c1-7(9(14)15)6-11-10(16)12-4-2-8(13)3-5-12/h7-8,13H,2-6H2,1H3,(H,11,16)(H,14,15)
InChIKeyDIPHCAXJYWHXFK-UHFFFAOYSA-N
MW230.26 g/mol
LogP-0.13
Rot. Bonds3

About 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid

3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid (PubChem CID 62670284) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid.

Molecular Properties

Compound Name3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid
PubChem CID62670284
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid
SMILESCC(CNC(=O)N1CCC(O)CC1)C(=O)O
InChIInChI=1S/C10H18N2O4/c1-7(9(14)15)6-11-10(16)12-4-2-8(13)3-5-12/h7-8,13H,2-6H2,1H3,(H,11,16)(H,14,15)
InChIKeyDIPHCAXJYWHXFK-UHFFFAOYSA-N
XLogP-0.13
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-3-[(4-propan-2-ylpiperidine-1-carbonyl)amino]propanoic acid
CID 103500221
4-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylbutanoic acid
CID 80540824
3-(azocane-1-carbonylamino)-2-methylpropanoic acid
CID 62669756
3-(azepane-1-carbonylamino)-2-methylpropanoic acid
CID 62671321
3-[[4-(2-amino-2-oxoethyl)piperidine-1-carbonyl]amino]-2-methylpropanoic acid
CID 62669034
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonylamino)-2-methylpropanoic acid
CID 115560898
3-[[4-(2-hydroxyethyl)piperazine-1-carbonyl]amino]-2-methylpropanoic acid
CID 62670111
3-[(4-ethoxycarbonylpiperazine-1-carbonyl)amino]-2-methylpropanoic acid
CID 107877477
2-[(4-hydroxypiperidine-1-carbonyl)amino]propanoic acid
CID 61189969
2-methyl-3-[(3,4,5-trimethylpiperazine-1-carbonyl)amino]propanoic acid
CID 114538694
(2S)-2-hydroxy-4-[(4-hydroxypiperidine-1-carbonyl)amino]butanoic acid
CID 107838122
3-[[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]amino]-2-methylpropanoic acid
CID 104959652

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid?
The IUPAC name of 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid (CID 62670284) is 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid.
What is the SMILES notation for 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid?
The canonical SMILES for 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid is CC(CNC(=O)N1CCC(O)CC1)C(=O)O.
What is the InChIKey of 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid?
The InChIKey is DIPHCAXJYWHXFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-7(9(14)15)6-11-10(16)12-4-2-8(13)3-5-12/h7-8,13H,2-6H2,1H3,(H,11,16)(H,14,15).
What are the key properties of 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid?
3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid has a molecular weight of 230.26 g/mol, XLogP of -0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxypiperidine-1-carbonyl)amino]-2-methylpropanoic acid is sourced from PubChem (CID 62670284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).