1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone

C17H18N4O2 — CID 124988103

IUPAC1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1cn[nH]c1[C@@H]1COCCN1C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H18N4O2/c1-11-9-18-20-16(11)15-10-23-7-6-21(15)17(22)14-8-12-4-2-3-5-13(12)19-14/h2-5,8-9,15,19H,6-7,10H2,1H3,(H,18,20)/t15-/m0/s1
InChIKeyOKPQFWNMMYJMMU-HNNXBMFYSA-N
MW310.36 g/mol
LogP2.41
Rot. Bonds2

About 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone

1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone (PubChem CID 124988103) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
PubChem CID124988103
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1cn[nH]c1[C@@H]1COCCN1C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H18N4O2/c1-11-9-18-20-16(11)15-10-23-7-6-21(15)17(22)14-8-12-4-2-3-5-13(12)19-14/h2-5,8-9,15,19H,6-7,10H2,1H3,(H,18,20)/t15-/m0/s1
InChIKeyOKPQFWNMMYJMMU-HNNXBMFYSA-N
XLogP2.41
TPSA74.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-3-(3,5-dimethyl-1H-pyrazol-4-yl)morpholin-4-yl]-(1H-indol-2-yl)methanone
CID 97251880
[(3R)-3-(3,5-dimethyl-1H-pyrazol-4-yl)morpholin-4-yl]-(1H-indol-2-yl)methanone
CID 97251879
1H-indol-2-yl-[3-(1,3,5-trimethylpyrazol-4-yl)morpholin-4-yl]methanone
CID 75471254
[3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]-pyridazin-4-ylmethanone
CID 110132433
methyl 4-(1H-indole-2-carbonyl)morpholine-3-carboxylate
CID 115670212
[3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]-(2-methylpyrimidin-5-yl)methanone
CID 110132430
(5-methylpyrazin-2-yl)-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
CID 124972296
(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
CID 124963161
[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]-[3-(1,2,4-triazol-4-yl)phenyl]methanone
CID 124990692
[3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]-pyrimidin-4-ylmethanone
CID 110132428
[3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]-(1,3-thiazol-5-yl)methanone
CID 110132537
(3-ethyl-1,2-oxazol-5-yl)-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone
CID 124972211

Frequently Asked Questions

What is the IUPAC name of 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The IUPAC name of 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone (CID 124988103) is 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone.
What is the SMILES notation for 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The canonical SMILES for 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone is Cc1cn[nH]c1[C@@H]1COCCN1C(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The InChIKey is OKPQFWNMMYJMMU-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-11-9-18-20-16(11)15-10-23-7-6-21(15)17(22)14-8-12-4-2-3-5-13(12)19-14/h2-5,8-9,15,19H,6-7,10H2,1H3,(H,18,20)/t15-/m0/s1.
What are the key properties of 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone?
1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone has a molecular weight of 310.36 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-2-yl-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 124988103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).