ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate

C14H25N3O3 — CID 108987901

IUPACethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H25N3O3/c1-2-20-14(19)17-10-6-12(7-11-17)15-13(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3,(H,15,18)
InChIKeyAKKXXVPNVIMCKQ-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.80
Rot. Bonds2

About ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate

ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate (PubChem CID 108987901) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate
PubChem CID108987901
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Nameethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H25N3O3/c1-2-20-14(19)17-10-6-12(7-11-17)15-13(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3,(H,15,18)
InChIKeyAKKXXVPNVIMCKQ-UHFFFAOYSA-N
XLogP1.80
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate 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

ethyl 4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]piperazine-1-carboxylate
CID 108989873
ethyl 4-[(3-oxo-3-piperidin-1-ylpropanoyl)amino]piperidine-1-carboxylate
CID 108942361
ethyl 4-[4-(cyclohexylcarbamoyl)piperazin-1-yl]piperidine-1-carboxylate
CID 113074692
propan-2-yl 4-(pyrrolidine-1-carbonylamino)piperidine-1-carboxylate
CID 124559521
ethyl azacycloundecane-1-carboxylate
CID 67670496
tert-butyl 4-(pyrrolidine-1-carbonylamino)piperidine-1-carboxylate
CID 53255659
N-cyclohexyl-4-(propanoylamino)piperidine-1-carboxamide
CID 110820925
ethyl 4-[[N-ethyl-N'-(2-oxo-2-pyrrolidin-1-ylethyl)carbamimidoyl]amino]piperidine-1-carboxylate
CID 111329836
ethyl 4-(ethylcarbamoylamino)piperidine-1-carboxylate
CID 47103610
ethyl 4-[[4-(propan-2-ylcarbamoyl)cyclohexanecarbonyl]amino]piperidine-1-carboxylate
CID 109144510
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
ethyl pyrrolidine-1-carboxylate;methanol
CID 153400940

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate?
The IUPAC name of ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate (CID 108987901) is ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate is CCOC(=O)N1CCC(NC(=O)N2CCCCC2)CC1.
What is the InChIKey of ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate?
The InChIKey is AKKXXVPNVIMCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-2-20-14(19)17-10-6-12(7-11-17)15-13(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3,(H,15,18).
What are the key properties of ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate?
ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate has a molecular weight of 283.37 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(piperidine-1-carbonylamino)piperidine-1-carboxylate is sourced from PubChem (CID 108987901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).