N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide

C22H23N3O3 — CID 52899027

IUPACN-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C22H23N3O3/c1-28-20-9-5-3-7-17(20)21(26)23-16-10-12-25(13-11-16)22(27)19-14-15-6-2-4-8-18(15)24-19/h2-9,14,16,24H,10-13H2,1H3,(H,23,26)
InChIKeyAZRIAGJZFLSJQY-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.21
Rot. Bonds4

About N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide

N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide (PubChem CID 52899027) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide
PubChem CID52899027
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C22H23N3O3/c1-28-20-9-5-3-7-17(20)21(26)23-16-10-12-25(13-11-16)22(27)19-14-15-6-2-4-8-18(15)24-19/h2-9,14,16,24H,10-13H2,1H3,(H,23,26)
InChIKeyAZRIAGJZFLSJQY-UHFFFAOYSA-N
XLogP3.21
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]acetamide
CID 49349124
2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide
CID 108549225
2-methoxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108549181
2-methoxy-N-[1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl]benzamide
CID 108549236
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 71704754
1H-indol-2-yl-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63250609
3,5-dimethoxy-N-[1-(2-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108550564
2-methoxy-N-[1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl]benzamide
CID 108549263
N-[4-[4-(2-methoxyphenyl)piperidin-1-yl]cyclohexyl]-1H-indole-2-carboxamide
CID 44524833
(2S)-N-cyclohexyl-2-[1-(1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 92503661
N-[1-(2-ethylbutanoyl)piperidin-4-yl]-2-methoxybenzamide
CID 110820045

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide?
The IUPAC name of N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide (CID 52899027) is N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide.
What is the SMILES notation for N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide?
The canonical SMILES for N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide is COc1ccccc1C(=O)NC1CCN(C(=O)c2cc3ccccc3[nH]2)CC1.
What is the InChIKey of N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide?
The InChIKey is AZRIAGJZFLSJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-28-20-9-5-3-7-17(20)21(26)23-16-10-12-25(13-11-16)22(27)19-14-15-6-2-4-8-18(15)24-19/h2-9,14,16,24H,10-13H2,1H3,(H,23,26).
What are the key properties of N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide?
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide has a molecular weight of 377.44 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methoxybenzamide is sourced from PubChem (CID 52899027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).