2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide

C15H14N4O2 — CID 71799748

IUPAC2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide
SMILESCOc1ncc(NC(=O)Cc2c[nH]c3ccccc23)cn1
InChIInChI=1S/C15H14N4O2/c1-21-15-17-8-11(9-18-15)19-14(20)6-10-7-16-13-5-3-2-4-12(10)13/h2-5,7-9,16H,6H2,1H3,(H,19,20)
InChIKeyRMSRWOUBDLBRTI-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.15
Rot. Bonds4

About 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide

2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide (PubChem CID 71799748) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide
PubChem CID71799748
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide
SMILESCOc1ncc(NC(=O)Cc2c[nH]c3ccccc23)cn1
InChIInChI=1S/C15H14N4O2/c1-21-15-17-8-11(9-18-15)19-14(20)6-10-7-16-13-5-3-2-4-12(10)13/h2-5,7-9,16H,6H2,1H3,(H,19,20)
InChIKeyRMSRWOUBDLBRTI-UHFFFAOYSA-N
XLogP2.15
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1H-indol-3-yl)-N-(3-methoxy-1H-1,2,4-triazol-5-yl)acetamide
CID 83093520
2-(1H-indol-3-yl)-N-[6-(4-methylphenoxy)-3-pyridinyl]acetamide
CID 52649446
2-(1H-indol-3-yl)-N-(4-pyrimidin-2-yloxyphenyl)acetamide
CID 47051345
2-(1H-indol-3-yl)-N-[5-(propan-2-ylamino)-2-pyridinyl]acetamide
CID 113023581
2-(4-fluorophenyl)-N-(2-methoxypyrimidin-5-yl)acetamide
CID 71799750
N-[6-(cyclopropylamino)-3-pyridinyl]-2-(1H-indol-3-yl)acetamide
CID 113009220
N-(2,4-diethoxypyrimidin-5-yl)-2-(1H-indol-3-yl)acetamide
CID 122304294
2-(1H-indol-3-yl)-N-[4-[(4-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982718
N-[6-(2-ethoxyanilino)-3-pyridinyl]-2-(1H-indol-3-yl)acetamide
CID 113019606
N-(4-bromophenyl)-2-(1H-indol-3-yl)acetamide
CID 2093840
2-(1H-indol-3-yl)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
CID 38738127
N-[6-(4-chloroanilino)-3-pyridinyl]-2-(1H-indol-3-yl)acetamide
CID 113018608

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide (CID 71799748) is 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide is COc1ncc(NC(=O)Cc2c[nH]c3ccccc23)cn1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide?
The InChIKey is RMSRWOUBDLBRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-15-17-8-11(9-18-15)19-14(20)6-10-7-16-13-5-3-2-4-12(10)13/h2-5,7-9,16H,6H2,1H3,(H,19,20).
What are the key properties of 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide?
2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide has a molecular weight of 282.30 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(2-methoxypyrimidin-5-yl)acetamide is sourced from PubChem (CID 71799748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).