N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide

C13H25N3O2 — CID 71103716

IUPACN-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide
SMILESCCNC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C13H25N3O2/c1-2-15-12(17)13(18)6-3-9-16(10-13)11-4-7-14-8-5-11/h11,14,18H,2-10H2,1H3,(H,15,17)
InChIKeySIUHSWWJAZRMPV-UHFFFAOYSA-N
MW255.36 g/mol
LogP-0.30
Rot. Bonds3

About N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide

N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide (PubChem CID 71103716) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide
PubChem CID71103716
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide
SMILESCCNC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C13H25N3O2/c1-2-15-12(17)13(18)6-3-9-16(10-13)11-4-7-14-8-5-11/h11,14,18H,2-10H2,1H3,(H,15,17)
InChIKeySIUHSWWJAZRMPV-UHFFFAOYSA-N
XLogP-0.30
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide?
The IUPAC name of N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide (CID 71103716) is N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide?
The canonical SMILES for N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide is CCNC(=O)C1(O)CCCN(C2CCNCC2)C1.
What is the InChIKey of N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide?
The InChIKey is SIUHSWWJAZRMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-2-15-12(17)13(18)6-3-9-16(10-13)11-4-7-14-8-5-11/h11,14,18H,2-10H2,1H3,(H,15,17).
What are the key properties of N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide?
N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide has a molecular weight of 255.36 g/mol, XLogP of -0.30, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-hydroxy-1-piperidin-4-ylpiperidine-3-carboxamide is sourced from PubChem (CID 71103716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).