N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide

C13H24N2O2 — CID 71937232

IUPACN-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide
SMILESCCOC1CCCN(C(=O)NC(C)C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-3-17-12-5-4-8-15(9-12)13(16)14-10(2)11-6-7-11/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyJNBGSBZUEVKVIW-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds4

About N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide

N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide (PubChem CID 71937232) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide
PubChem CID71937232
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide
SMILESCCOC1CCCN(C(=O)NC(C)C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-3-17-12-5-4-8-15(9-12)13(16)14-10(2)11-6-7-11/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyJNBGSBZUEVKVIW-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide (CID 71937232) is N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide is CCOC1CCCN(C(=O)NC(C)C2CC2)C1.
What is the InChIKey of N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide?
The InChIKey is JNBGSBZUEVKVIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-17-12-5-4-8-15(9-12)13(16)14-10(2)11-6-7-11/h10-12H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide?
N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-3-ethoxypiperidine-1-carboxamide is sourced from PubChem (CID 71937232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).