N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide

C18H35N3O — CID 19804230

IUPACN,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide
SMILESCCN(CC)C(=O)C1CCCN(CCCC2CCCNC2)C1
InChIInChI=1S/C18H35N3O/c1-3-21(4-2)18(22)17-10-7-13-20(15-17)12-6-9-16-8-5-11-19-14-16/h16-17,19H,3-15H2,1-2H3
InChIKeyOOFLUZKLGGEZSQ-UHFFFAOYSA-N
MW309.50 g/mol
LogP2.35
Rot. Bonds7

About N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide

N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide (PubChem CID 19804230) has the molecular formula C18H35N3O and a molecular weight of 309.50 g/mol. Its IUPAC name is N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide
PubChem CID19804230
Molecular FormulaC18H35N3O
Molecular Weight309.50 g/mol
Exact Mass309.28
IUPAC NameN,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide
SMILESCCN(CC)C(=O)C1CCCN(CCCC2CCCNC2)C1
InChIInChI=1S/C18H35N3O/c1-3-21(4-2)18(22)17-10-7-13-20(15-17)12-6-9-16-8-5-11-19-14-16/h16-17,19H,3-15H2,1-2H3
InChIKeyOOFLUZKLGGEZSQ-UHFFFAOYSA-N
XLogP2.35
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.50
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide?
The IUPAC name of N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide (CID 19804230) is N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide?
The canonical SMILES for N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide is CCN(CC)C(=O)C1CCCN(CCCC2CCCNC2)C1.
What is the InChIKey of N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide?
The InChIKey is OOFLUZKLGGEZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O/c1-3-21(4-2)18(22)17-10-7-13-20(15-17)12-6-9-16-8-5-11-19-14-16/h16-17,19H,3-15H2,1-2H3.
What are the key properties of N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide?
N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide has a molecular weight of 309.50 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(3-piperidin-3-ylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 19804230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).