N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide

C16H14ClN3O2 — CID 141490365

IUPACN-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide
SMILESCOn1cc(CC(=O)Nc2ccncc2Cl)c2ccccc21
InChIInChI=1S/C16H14ClN3O2/c1-22-20-10-11(12-4-2-3-5-15(12)20)8-16(21)19-14-6-7-18-9-13(14)17/h2-7,9-10H,8H2,1H3,(H,18,19,21)
InChIKeyIRTAOXGVJYVRSN-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.93
Rot. Bonds4

About N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide

N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide (PubChem CID 141490365) has the molecular formula C16H14ClN3O2 and a molecular weight of 315.76 g/mol. Its IUPAC name is N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide
PubChem CID141490365
Molecular FormulaC16H14ClN3O2
Molecular Weight315.76 g/mol
Exact Mass315.08
IUPAC NameN-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide
SMILESCOn1cc(CC(=O)Nc2ccncc2Cl)c2ccccc21
InChIInChI=1S/C16H14ClN3O2/c1-22-20-10-11(12-4-2-3-5-15(12)20)8-16(21)19-14-6-7-18-9-13(14)17/h2-7,9-10H,8H2,1H3,(H,18,19,21)
InChIKeyIRTAOXGVJYVRSN-UHFFFAOYSA-N
XLogP2.93
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide?
The IUPAC name of N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide (CID 141490365) is N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide.
What is the SMILES notation for N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide?
The canonical SMILES for N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide is COn1cc(CC(=O)Nc2ccncc2Cl)c2ccccc21.
What is the InChIKey of N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide?
The InChIKey is IRTAOXGVJYVRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2/c1-22-20-10-11(12-4-2-3-5-15(12)20)8-16(21)19-14-6-7-18-9-13(14)17/h2-7,9-10H,8H2,1H3,(H,18,19,21).
What are the key properties of N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide?
N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide has a molecular weight of 315.76 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-pyridinyl)-2-(1-methoxyindol-3-yl)acetamide is sourced from PubChem (CID 141490365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).