1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid

C14H25N3O4 — CID 43348298

IUPAC1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C(=O)NCCCN2CCOCC2)CC1
InChIInChI=1S/C14H25N3O4/c18-13(19)12-2-6-17(7-3-12)14(20)15-4-1-5-16-8-10-21-11-9-16/h12H,1-11H2,(H,15,20)(H,18,19)
InChIKeyVFEHHCICXGXEEI-UHFFFAOYSA-N
MW299.37 g/mol
LogP0.21
Rot. Bonds5

About 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid

1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid (PubChem CID 43348298) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid
PubChem CID43348298
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC Name1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C(=O)NCCCN2CCOCC2)CC1
InChIInChI=1S/C14H25N3O4/c18-13(19)12-2-6-17(7-3-12)14(20)15-4-1-5-16-8-10-21-11-9-16/h12H,1-11H2,(H,15,20)(H,18,19)
InChIKeyVFEHHCICXGXEEI-UHFFFAOYSA-N
XLogP0.21
TPSA82.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic 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

N-(3-morpholin-4-ylpropyl)-4-phenylpiperazine-1-carboxamide
CID 14763453
(3R)-1-(2-morpholin-4-ylethylcarbamoyl)piperidine-3-carboxylic acid
CID 81120691
2-[1-(3-morpholin-4-ylpropylcarbamoyl)azetidin-3-yl]propanoic acid
CID 116682866
N-butyl-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113103857
N-[3-(dimethylamino)propyl]-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105897
1-(3-cyclopentylpropylcarbamoyl)piperidine-4-carboxylic acid
CID 106005313
1-(3-methylsulfanylpropylcarbamoyl)piperidine-4-carboxylic acid
CID 63959215
2-(3-morpholin-4-ylpropylamino)-2-oxoacetic acid
CID 43444981
1-(2-chloroethylcarbamoyl)piperidine-4-carboxylic acid
CID 16769941
N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
1-(3-ethoxypropylcarbamoyl)piperidine-4-carboxylic acid
CID 43318547
2-(4-methylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
CID 108504537

Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid?
The IUPAC name of 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid (CID 43348298) is 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid?
The canonical SMILES for 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid is O=C(O)C1CCN(C(=O)NCCCN2CCOCC2)CC1.
What is the InChIKey of 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid?
The InChIKey is VFEHHCICXGXEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c18-13(19)12-2-6-17(7-3-12)14(20)15-4-1-5-16-8-10-21-11-9-16/h12H,1-11H2,(H,15,20)(H,18,19).
What are the key properties of 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid?
1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid has a molecular weight of 299.37 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropylcarbamoyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 43348298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).