4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide

C17H32N4O3 — CID 86870828

IUPAC4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide
SMILESCCCNC(=O)CCNC(=O)N1CCC(C(=O)N(CC)CC)CC1
InChIInChI=1S/C17H32N4O3/c1-4-10-18-15(22)7-11-19-17(24)21-12-8-14(9-13-21)16(23)20(5-2)6-3/h14H,4-13H2,1-3H3,(H,18,22)(H,19,24)
InChIKeyNOAQWCCELWDYNZ-UHFFFAOYSA-N
MW340.47 g/mol
LogP1.19
Rot. Bonds8

About 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide

4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide (PubChem CID 86870828) has the molecular formula C17H32N4O3 and a molecular weight of 340.47 g/mol. Its IUPAC name is 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide
PubChem CID86870828
Molecular FormulaC17H32N4O3
Molecular Weight340.47 g/mol
Exact Mass340.25
IUPAC Name4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide
SMILESCCCNC(=O)CCNC(=O)N1CCC(C(=O)N(CC)CC)CC1
InChIInChI=1S/C17H32N4O3/c1-4-10-18-15(22)7-11-19-17(24)21-12-8-14(9-13-21)16(23)20(5-2)6-3/h14H,4-13H2,1-3H3,(H,18,22)(H,19,24)
InChIKeyNOAQWCCELWDYNZ-UHFFFAOYSA-N
XLogP1.19
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide with MolForge

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Related Compounds

1-N-[3-(butan-2-ylamino)-3-oxopropyl]-4-N,4-N-dimethylpiperidine-1,4-dicarboxamide
CID 87036409
4-(cyclopropanecarbonyl)-N-propylpiperazine-1-carboxamide
CID 23794806
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
4-(N'-hydroxycarbamimidoyl)-N-propylpiperidine-1-carboxamide
CID 77039009
N-[3-(ethylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
CID 116657786
4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide
CID 110364786
4-butanoyl-N-propylpiperazine-1-carboxamide
CID 110810606
(3S)-1-N-decyl-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 70998444
N,N-diethyl-1-(2-ethylbutanoyl)piperidine-4-carboxamide
CID 113005259
4-[3-(diethylamino)propanoyl]-N-propylpiperazine-1-carboxamide
CID 110422402
1-[4-oxo-4-(propylamino)butanoyl]pyrrolidine-3-carboxylic acid
CID 119355311
4-methyl-N-[2-(propylamino)ethyl]piperidine-1-carboxamide
CID 79163549

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide (CID 86870828) is 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide is CCCNC(=O)CCNC(=O)N1CCC(C(=O)N(CC)CC)CC1.
What is the InChIKey of 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide?
The InChIKey is NOAQWCCELWDYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4O3/c1-4-10-18-15(22)7-11-19-17(24)21-12-8-14(9-13-21)16(23)20(5-2)6-3/h14H,4-13H2,1-3H3,(H,18,22)(H,19,24).
What are the key properties of 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide?
4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide has a molecular weight of 340.47 g/mol, XLogP of 1.19, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-1-N-[3-oxo-3-(propylamino)propyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 86870828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).