1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide

C22H24N4O2 — CID 55896436

IUPAC1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide
SMILESCc1cccnc1NC(=O)C1CCCN(C(=O)c2cc3ccccc3n2C)C1
InChIInChI=1S/C22H24N4O2/c1-15-7-5-11-23-20(15)24-21(27)17-9-6-12-26(14-17)22(28)19-13-16-8-3-4-10-18(16)25(19)2/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3,(H,23,24,27)
InChIKeyRECAJTJDITYIIV-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.37
Rot. Bonds3

About 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide

1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide (PubChem CID 55896436) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide
PubChem CID55896436
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide
SMILESCc1cccnc1NC(=O)C1CCCN(C(=O)c2cc3ccccc3n2C)C1
InChIInChI=1S/C22H24N4O2/c1-15-7-5-11-23-20(15)24-21(27)17-9-6-12-26(14-17)22(28)19-13-16-8-3-4-10-18(16)25(19)2/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3,(H,23,24,27)
InChIKeyRECAJTJDITYIIV-UHFFFAOYSA-N
XLogP3.37
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide?
The IUPAC name of 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide (CID 55896436) is 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide is Cc1cccnc1NC(=O)C1CCCN(C(=O)c2cc3ccccc3n2C)C1.
What is the InChIKey of 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide?
The InChIKey is RECAJTJDITYIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-15-7-5-11-23-20(15)24-21(27)17-9-6-12-26(14-17)22(28)19-13-16-8-3-4-10-18(16)25(19)2/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3,(H,23,24,27).
What are the key properties of 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide?
1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylindole-2-carbonyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide is sourced from PubChem (CID 55896436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).