1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide

C23H26N4O2 — CID 55815306

IUPAC1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccnc(NC(=O)C2CCN(C(=O)Cn3c(C)cc4ccccc43)CC2)c1
InChIInChI=1S/C23H26N4O2/c1-16-7-10-24-21(13-16)25-23(29)18-8-11-26(12-9-18)22(28)15-27-17(2)14-19-5-3-4-6-20(19)27/h3-7,10,13-14,18H,8-9,11-12,15H2,1-2H3,(H,24,25,29)
InChIKeyDREKTBRHKARVOX-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.53
Rot. Bonds4

About 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide

1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 55815306) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID55815306
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccnc(NC(=O)C2CCN(C(=O)Cn3c(C)cc4ccccc43)CC2)c1
InChIInChI=1S/C23H26N4O2/c1-16-7-10-24-21(13-16)25-23(29)18-8-11-26(12-9-18)22(28)15-27-17(2)14-19-5-3-4-6-20(19)27/h3-7,10,13-14,18H,8-9,11-12,15H2,1-2H3,(H,24,25,29)
InChIKeyDREKTBRHKARVOX-UHFFFAOYSA-N
XLogP3.53
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methyl-2-pyridinyl)-1-[2-oxo-2-[4-(phenylcarbamoyl)piperidin-1-yl]ethyl]piperidine-4-carboxamide
CID 55922165
N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 46411285
1-(2-fluorobenzoyl)-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 17019017
1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(2-methylindol-1-yl)ethanone
CID 17489605
1-[4-(4-chlorophenyl)butanoyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55930872
2-(2-methylindol-1-yl)-1-(4-phenylmethoxypiperidin-1-yl)ethanone
CID 46448492
1-[2-(2,5-dichlorophenoxy)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 60547252
1-[2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55816301
ethyl 4-[2-(2-methylindol-1-yl)acetyl]piperazine-1-carboxylate
CID 36841011
2-(2-methylindol-1-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 42024048
1-(3-methyl-1-benzofuran-2-carbonyl)-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55931370
1-[2-[4-(difluoromethoxy)phenyl]acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55931889

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide (CID 55815306) is 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide is Cc1ccnc(NC(=O)C2CCN(C(=O)Cn3c(C)cc4ccccc43)CC2)c1.
What is the InChIKey of 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is DREKTBRHKARVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-16-7-10-24-21(13-16)25-23(29)18-8-11-26(12-9-18)22(28)15-27-17(2)14-19-5-3-4-6-20(19)27/h3-7,10,13-14,18H,8-9,11-12,15H2,1-2H3,(H,24,25,29).
What are the key properties of 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide?
1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 55815306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).