N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride

C13H27Cl2N3O2 — CID 119827240

IUPACN-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NCCCN1CCOCC1)C1CCCCN1
InChIInChI=1S/C13H25N3O2.2ClH/c17-13(12-4-1-2-5-14-12)15-6-3-7-16-8-10-18-11-9-16;;/h12,14H,1-11H2,(H,15,17);2*1H
InChIKeyWGWCLHZQJWHHHO-UHFFFAOYSA-N
MW328.28 g/mol
LogP0.81
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride

N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride (PubChem CID 119827240) has the molecular formula C13H27Cl2N3O2 and a molecular weight of 328.28 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride
PubChem CID119827240
Molecular FormulaC13H27Cl2N3O2
Molecular Weight328.28 g/mol
Exact Mass327.15
IUPAC NameN-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NCCCN1CCOCC1)C1CCCCN1
InChIInChI=1S/C13H25N3O2.2ClH/c17-13(12-4-1-2-5-14-12)15-6-3-7-16-8-10-18-11-9-16;;/h12,14H,1-11H2,(H,15,17);2*1H
InChIKeyWGWCLHZQJWHHHO-UHFFFAOYSA-N
XLogP0.81
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.28
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride 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

(2R)-N-(4-morpholin-4-ylbutyl)piperidine-2-carboxamide
CID 119852461
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 119863890
N-(3-morpholin-4-yl-3-oxopropyl)piperidine-2-carboxamide
CID 112687692
(2R)-N-(3-morpholin-4-yl-3-oxopropyl)piperidine-2-carboxamide
CID 103808375
(2S)-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide
CID 61154018
(2R)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-2-carboxamide;dihydrochloride
CID 119834947
(4R)-N-(3-morpholin-4-ylpropyl)azepane-4-carboxamide
CID 125446683
5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide
CID 63102385
N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide
CID 119334628
N-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-2-carboxamide
CID 119262246
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-2-carboxamide
CID 119834969
N-(4,4,4-trifluorobutyl)piperidine-2-carboxamide
CID 81434241

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride?
The IUPAC name of N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride (CID 119827240) is N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride is Cl.Cl.O=C(NCCCN1CCOCC1)C1CCCCN1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride?
The InChIKey is WGWCLHZQJWHHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2.2ClH/c17-13(12-4-1-2-5-14-12)15-6-3-7-16-8-10-18-11-9-16;;/h12,14H,1-11H2,(H,15,17);2*1H.
What are the key properties of N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride?
N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride has a molecular weight of 328.28 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119827240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).