4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide

C17H32N4O3 — CID 94070515

IUPAC4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
SMILESC[C@@H]1CN(CCNC(=O)C2CCN(C(=O)N(C)C)CC2)C[C@H](C)O1
InChIInChI=1S/C17H32N4O3/c1-13-11-20(12-14(2)24-13)10-7-18-16(22)15-5-8-21(9-6-15)17(23)19(3)4/h13-15H,5-12H2,1-4H3,(H,18,22)/t13-,14+
InChIKeyWSAVULGOWCBOSZ-OKILXGFUSA-N
MW340.47 g/mol
LogP0.61
Rot. Bonds4

About 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide

4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide (PubChem CID 94070515) has the molecular formula C17H32N4O3 and a molecular weight of 340.47 g/mol. Its IUPAC name is 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
PubChem CID94070515
Molecular FormulaC17H32N4O3
Molecular Weight340.47 g/mol
Exact Mass340.25
IUPAC Name4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
SMILESC[C@@H]1CN(CCNC(=O)C2CCN(C(=O)N(C)C)CC2)C[C@H](C)O1
InChIInChI=1S/C17H32N4O3/c1-13-11-20(12-14(2)24-13)10-7-18-16(22)15-5-8-21(9-6-15)17(23)19(3)4/h13-15H,5-12H2,1-4H3,(H,18,22)/t13-,14+
InChIKeyWSAVULGOWCBOSZ-OKILXGFUSA-N
XLogP0.61
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide with MolForge

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Related Compounds

1-[(diethylamino)sulfonyl]-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 3236936
1-[(diisobutylamino)sulfonyl]-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 3245563
3-N,3-N-diethyl-1-N-(2-morpholin-4-ylethyl)piperidine-1,3-dicarboxamide
CID 172437921
N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 5157518
9-(4-acetamidobutanoyl)-N-propan-2-yl-1-oxa-4,9-diazaspiro[5.5]undecane-4-carboxamide
CID 134787423
9-(4-aminobutanoyl)-N-propan-2-yl-1-oxa-4,9-diazaspiro[5.5]undecane-4-carboxamide
CID 134789697
N-[4-[9-(4-aminobutanoyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-4-oxobutyl]acetamide
CID 134791130
4-(4-acetamidobutanoyl)-N-propan-2-yl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxamide
CID 134791154
4-Fluoro-4-(morpholine-4-carbonyl)-N-propylpiperidine-1-carboxamide
CID 132443361
(3R,4S)-3-ethyl-4-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-N-propan-2-ylpiperidine-1-carboxamide
CID 28991281
N-ethyl-N'-[2-[methyl(2,2,2-trifluoroethyl)amino]ethyl]-4-(morpholine-4-carbonyl)piperidine-1-carboximidamide
CID 112019733
N-Ethyl-4-fluoro-4-(morpholine-4-carbonyl)piperidine-1-carboxamide
CID 124053388

Frequently Asked Questions

What is the IUPAC name of 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide (CID 94070515) is 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide is C[C@@H]1CN(CCNC(=O)C2CCN(C(=O)N(C)C)CC2)C[C@H](C)O1.
What is the InChIKey of 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The InChIKey is WSAVULGOWCBOSZ-OKILXGFUSA-N. The full InChI is InChI=1S/C17H32N4O3/c1-13-11-20(12-14(2)24-13)10-7-18-16(22)15-5-8-21(9-6-15)17(23)19(3)4/h13-15H,5-12H2,1-4H3,(H,18,22)/t13-,14+.
What are the key properties of 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide has a molecular weight of 340.47 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 94070515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).