2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide

C20H23N5O2 — CID 91967492

IUPAC2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
SMILESCc1cc(CNC(=O)Cc2c[nH]c3ccccc23)nc(N2CCOCC2)n1
InChIInChI=1S/C20H23N5O2/c1-14-10-16(24-20(23-14)25-6-8-27-9-7-25)13-22-19(26)11-15-12-21-18-5-3-2-4-17(15)18/h2-5,10,12,21H,6-9,11,13H2,1H3,(H,22,26)
InChIKeyMLSDQXVTPLEAHU-UHFFFAOYSA-N
MW365.44 g/mol
LogP1.96
Rot. Bonds5

About 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide

2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide (PubChem CID 91967492) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
PubChem CID91967492
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
SMILESCc1cc(CNC(=O)Cc2c[nH]c3ccccc23)nc(N2CCOCC2)n1
InChIInChI=1S/C20H23N5O2/c1-14-10-16(24-20(23-14)25-6-8-27-9-7-25)13-22-19(26)11-15-12-21-18-5-3-2-4-17(15)18/h2-5,10,12,21H,6-9,11,13H2,1H3,(H,22,26)
InChIKeyMLSDQXVTPLEAHU-UHFFFAOYSA-N
XLogP1.96
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-(3-methylphenyl)acetamide
CID 122353695
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylpropanamide
CID 91967478
2-chloro-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 72718377
1-methyl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]triazole-4-carboxamide
CID 122353728
1-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylurea
CID 91967530
2-indol-1-yl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide
CID 122353777
2-(1H-indol-3-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
CID 25479539
2-ethoxy-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]naphthalene-1-carboxamide
CID 122353684
N-[4,6-dimethyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-2-(1H-indol-3-yl)acetamide
CID 122357083
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-pyrimidin-2-yloxyacetamide
CID 72718392
2-(2-chlorophenyl)-N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]acetamide
CID 122352355
2-fluoro-N-methyl-N-[2-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methylamino]-2-oxoethyl]benzamide
CID 91967565

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide (CID 91967492) is 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide is Cc1cc(CNC(=O)Cc2c[nH]c3ccccc23)nc(N2CCOCC2)n1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide?
The InChIKey is MLSDQXVTPLEAHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-14-10-16(24-20(23-14)25-6-8-27-9-7-25)13-22-19(26)11-15-12-21-18-5-3-2-4-17(15)18/h2-5,10,12,21H,6-9,11,13H2,1H3,(H,22,26).
What are the key properties of 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide?
2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide has a molecular weight of 365.44 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]acetamide is sourced from PubChem (CID 91967492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).