1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one

C17H32N4O3 — CID 95582475

IUPAC1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
SMILESC[C@@H]1CN(C[C@H](O)CN2CCC(N3CCNC3=O)CC2)C[C@@H](C)O1
InChIInChI=1S/C17H32N4O3/c1-13-9-20(10-14(2)24-13)12-16(22)11-19-6-3-15(4-7-19)21-8-5-18-17(21)23/h13-16,22H,3-12H2,1-2H3,(H,18,23)/t13-,14-,16-/m1/s1
InChIKeySSGZCJKXRZAQRR-IIAWOOMASA-N
MW340.47 g/mol
LogP-0.05
Rot. Bonds5

About 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 95582475) has the molecular formula C17H32N4O3 and a molecular weight of 340.47 g/mol. Its IUPAC name is 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID95582475
Molecular FormulaC17H32N4O3
Molecular Weight340.47 g/mol
Exact Mass340.25
IUPAC Name1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
SMILESC[C@@H]1CN(C[C@H](O)CN2CCC(N3CCNC3=O)CC2)C[C@@H](C)O1
InChIInChI=1S/C17H32N4O3/c1-13-9-20(10-14(2)24-13)12-16(22)11-19-6-3-15(4-7-19)21-8-5-18-17(21)23/h13-16,22H,3-12H2,1-2H3,(H,18,23)/t13-,14-,16-/m1/s1
InChIKeySSGZCJKXRZAQRR-IIAWOOMASA-N
XLogP-0.05
TPSA68.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-bis(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 70522448
1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one
CID 18340088
1-[1-[(2S)-3-(4-fluorophenoxy)-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
CID 94392487
1-(2,6-dimethylmorpholin-4-yl)-3-(9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonan-3-yl)propan-2-ol
CID 111512146
1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one
CID 94392496
1-[1-[(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]piperidin-4-yl]imidazolidin-2-one
CID 95329642
1-(1-propylpiperidin-4-yl)imidazolidin-2-one
CID 18340097
1-(1-propylpyrrolidin-3-yl)imidazolidin-2-one
CID 131114947
1-(4,4-dimethylazepan-1-yl)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 111462765
1-bromo-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 104959987
1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one
CID 54872430
(2S)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-[(3R)-4-[(2S)-2-hydroxypropyl]-3-methylpiperazin-1-yl]propan-2-ol
CID 124826594

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one (CID 95582475) is 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one is C[C@@H]1CN(C[C@H](O)CN2CCC(N3CCNC3=O)CC2)C[C@@H](C)O1.
What is the InChIKey of 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is SSGZCJKXRZAQRR-IIAWOOMASA-N. The full InChI is InChI=1S/C17H32N4O3/c1-13-9-20(10-14(2)24-13)12-16(22)11-19-6-3-15(4-7-19)21-8-5-18-17(21)23/h13-16,22H,3-12H2,1-2H3,(H,18,23)/t13-,14-,16-/m1/s1.
What are the key properties of 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 340.47 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 95582475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).