[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone

C23H40N4O3 — CID 95550011

IUPAC[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCCN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(C(=O)N3CCOCC3)CC2)CC1
InChIInChI=1S/C23H40N4O3/c1-2-24-10-4-3-5-21(24)23(29)26-13-8-20(9-14-26)25-11-6-19(7-12-25)22(28)27-15-17-30-18-16-27/h19-21H,2-18H2,1H3/t21-/m1/s1
InChIKeyWZZHHCUVNUVMNG-OAQYLSRUSA-N
MW420.60 g/mol
LogP1.42
Rot. Bonds4

About [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone

[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 95550011) has the molecular formula C23H40N4O3 and a molecular weight of 420.60 g/mol. Its IUPAC name is [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID95550011
Molecular FormulaC23H40N4O3
Molecular Weight420.60 g/mol
Exact Mass420.31
IUPAC Name[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCCN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(C(=O)N3CCOCC3)CC2)CC1
InChIInChI=1S/C23H40N4O3/c1-2-24-10-4-3-5-21(24)23(29)26-13-8-20(9-14-26)25-11-6-19(7-12-25)22(28)27-15-17-30-18-16-27/h19-21H,2-18H2,1H3/t21-/m1/s1
InChIKeyWZZHHCUVNUVMNG-OAQYLSRUSA-N
XLogP1.42
TPSA56.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.60
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-ethylpiperidin-2-yl)-morpholin-4-ylmethanone
CID 142202703
1-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]butan-1-one
CID 42693440
morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone
CID 25368630
[1-[4-[2-(morpholine-4-carbonyl)piperidin-1-yl]but-2-ynyl]piperidin-2-yl]-morpholin-4-ylmethanone
CID 166220087
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 110604424
(4-ethylpiperidin-1-yl)-(4-morpholin-4-ylcyclohexyl)methanone
CID 126834550
[1-(2-hydroxycyclohexyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 110883607
[1-(3,3-dimethylcyclopentyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 154564551
[1-[1-(3,5-dimethoxybenzoyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 42693463
morpholin-4-yl-[(2S)-1-[[(2R)-oxiran-2-yl]methyl]pyrrolidin-2-yl]methanone
CID 97181537
[1-[1-[(2-hydroxyphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 42457414
3-[2-(morpholine-4-carbonyl)piperidin-1-yl]-1-piperazin-1-ylpropan-1-one
CID 120981521

Frequently Asked Questions

What is the IUPAC name of [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone (CID 95550011) is [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone is CCN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(C(=O)N3CCOCC3)CC2)CC1.
What is the InChIKey of [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is WZZHHCUVNUVMNG-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H40N4O3/c1-2-24-10-4-3-5-21(24)23(29)26-13-8-20(9-14-26)25-11-6-19(7-12-25)22(28)27-15-17-30-18-16-27/h19-21H,2-18H2,1H3/t21-/m1/s1.
What are the key properties of [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
[1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 420.60 g/mol, XLogP of 1.42, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-[(2R)-1-ethylpiperidine-2-carbonyl]piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 95550011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).