(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one

C18H30N4O2 — CID 95337848

IUPAC(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one
SMILESCC(C)c1nccn1[C@@H]1CCCN(C(=O)[C@@H](C)N2CCOCC2)C1
InChIInChI=1S/C18H30N4O2/c1-14(2)17-19-6-8-22(17)16-5-4-7-21(13-16)18(23)15(3)20-9-11-24-12-10-20/h6,8,14-16H,4-5,7,9-13H2,1-3H3/t15-,16-/m1/s1
InChIKeyIRDHVTSPERYJQC-HZPDHXFCSA-N
MW334.46 g/mol
LogP1.89
Rot. Bonds4

About (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one

(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one (PubChem CID 95337848) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one
PubChem CID95337848
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC Name(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one
SMILESCC(C)c1nccn1[C@@H]1CCCN(C(=O)[C@@H](C)N2CCOCC2)C1
InChIInChI=1S/C18H30N4O2/c1-14(2)17-19-6-8-22(17)16-5-4-7-21(13-16)18(23)15(3)20-9-11-24-12-10-20/h6,8,14-16H,4-5,7,9-13H2,1-3H3/t15-,16-/m1/s1
InChIKeyIRDHVTSPERYJQC-HZPDHXFCSA-N
XLogP1.89
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

[(2R)-oxolan-2-yl]-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 95349495
[(1R)-cyclohex-3-en-1-yl]-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 95336356
3-[(2S)-oxolan-2-yl]-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one
CID 95352561
N-[(2S)-2-cyclopropyl-1-oxo-1-[(3S)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-2-yl]acetamide
CID 95343954
[(3S)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]-[(2S)-1-propylpyrrolidin-2-yl]methanone
CID 95353974
2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3S)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]ethanone
CID 95736318
2-(2-methyl-1,3-thiazol-4-yl)-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]ethanone
CID 95343040
2-methyl-1-[3-[2-(2-morpholin-4-ylpyrimidin-5-yl)imidazol-1-yl]piperidin-1-yl]propan-1-one
CID 70715847
2-methyl-6-[(3S)-3-(2-propan-2-ylimidazol-1-yl)piperidine-1-carbonyl]pyridazin-3-one
CID 95736313
1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]-2-(tetrazol-1-yl)ethanone
CID 95606682
1-[(3S)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]-2-(tetrazol-1-yl)ethanone
CID 95606683
2H-benzotriazol-5-yl-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 95343023

Frequently Asked Questions

What is the IUPAC name of (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one?
The IUPAC name of (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one (CID 95337848) is (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one?
The canonical SMILES for (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one is CC(C)c1nccn1[C@@H]1CCCN(C(=O)[C@@H](C)N2CCOCC2)C1.
What is the InChIKey of (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one?
The InChIKey is IRDHVTSPERYJQC-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-14(2)17-19-6-8-22(17)16-5-4-7-21(13-16)18(23)15(3)20-9-11-24-12-10-20/h6,8,14-16H,4-5,7,9-13H2,1-3H3/t15-,16-/m1/s1.
What are the key properties of (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one?
(2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one has a molecular weight of 334.46 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-morpholin-4-yl-1-[(3R)-3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 95337848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).