N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide

C22H24N4O3 — CID 72870229

IUPACN-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide
SMILESCOc1ncccc1C(=O)N1CCCC(CNC(=O)c2cc3ccccc3[nH]2)C1
InChIInChI=1S/C22H24N4O3/c1-29-21-17(8-4-10-23-21)22(28)26-11-5-6-15(14-26)13-24-20(27)19-12-16-7-2-3-9-18(16)25-19/h2-4,7-10,12,15,25H,5-6,11,13-14H2,1H3,(H,24,27)
InChIKeyNKUXEIWGUFFMJW-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.85
Rot. Bonds5

About N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide

N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide (PubChem CID 72870229) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide
PubChem CID72870229
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide
SMILESCOc1ncccc1C(=O)N1CCCC(CNC(=O)c2cc3ccccc3[nH]2)C1
InChIInChI=1S/C22H24N4O3/c1-29-21-17(8-4-10-23-21)22(28)26-11-5-6-15(14-26)13-24-20(27)19-12-16-7-2-3-9-18(16)25-19/h2-4,7-10,12,15,25H,5-6,11,13-14H2,1H3,(H,24,27)
InChIKeyNKUXEIWGUFFMJW-UHFFFAOYSA-N
XLogP2.85
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide with MolForge

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Related Compounds

ethyl 3-[[(3R)-3-[(1H-indole-2-carbonylamino)methyl]piperidine-1-carbonyl]amino]propanoate
CID 25461417
[3-(bromomethyl)piperidin-1-yl]-(2-methoxy-3-pyridinyl)methanone
CID 80660116
N-[[(3S)-1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide
CID 26399006
N-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]-1H-indole-2-carboxamide
CID 131896123
(2-methoxy-3-pyridinyl)-[(3S)-3-(quinolin-8-ylmethyl)piperidin-1-yl]methanone
CID 125000469
(2-methoxy-3-pyridinyl)-[(3R)-3-(quinolin-5-ylmethyl)piperidin-1-yl]methanone
CID 124982563
N-[[(3S)-1-(2-ethoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-2-methylpropanamide
CID 94821205
N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-2-carboxamide
CID 140931178
N-[[1-(2-ethoxypyridine-3-carbonyl)piperidin-3-yl]methyl]butanamide
CID 51107687
[(3R)-3-(1H-benzimidazol-2-ylmethyl)piperidin-1-yl]-(2-ethoxy-3-pyridinyl)methanone
CID 97136974
3-[3-(methylaminomethyl)piperidine-1-carbonyl]-1H-quinolin-2-one;hydrochloride
CID 119396572
(2-methoxy-3-pyridinyl)-[(3S)-3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]methanone
CID 96514391

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide (CID 72870229) is N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide is COc1ncccc1C(=O)N1CCCC(CNC(=O)c2cc3ccccc3[nH]2)C1.
What is the InChIKey of N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide?
The InChIKey is NKUXEIWGUFFMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-29-21-17(8-4-10-23-21)22(28)26-11-5-6-15(14-26)13-24-20(27)19-12-16-7-2-3-9-18(16)25-19/h2-4,7-10,12,15,25H,5-6,11,13-14H2,1H3,(H,24,27).
What are the key properties of N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide?
N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 72870229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).