2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide

C14H26N2O — CID 110754789

IUPAC2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CC1CCN(C2CC2)CC1
InChIInChI=1S/C14H26N2O/c1-3-15(4-2)14(17)11-12-7-9-16(10-8-12)13-5-6-13/h12-13H,3-11H2,1-2H3
InChIKeyDVKPXEFRLNMBDB-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.12
Rot. Bonds5

About 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide

2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide (PubChem CID 110754789) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide
PubChem CID110754789
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CC1CCN(C2CC2)CC1
InChIInChI=1S/C14H26N2O/c1-3-15(4-2)14(17)11-12-7-9-16(10-8-12)13-5-6-13/h12-13H,3-11H2,1-2H3
InChIKeyDVKPXEFRLNMBDB-UHFFFAOYSA-N
XLogP2.12
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide?
The IUPAC name of 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide (CID 110754789) is 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide?
The canonical SMILES for 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide is CCN(CC)C(=O)CC1CCN(C2CC2)CC1.
What is the InChIKey of 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide?
The InChIKey is DVKPXEFRLNMBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-15(4-2)14(17)11-12-7-9-16(10-8-12)13-5-6-13/h12-13H,3-11H2,1-2H3.
What are the key properties of 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide?
2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide has a molecular weight of 238.37 g/mol, XLogP of 2.12, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylpiperidin-4-yl)-N,N-diethylacetamide is sourced from PubChem (CID 110754789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).