1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide

C20H29N3O4 — CID 119427113

IUPAC1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide
SMILESCOc1cc(OC)cc(C(=O)N2CCC(C(=O)NC3CCCNC3)CC2)c1
InChIInChI=1S/C20H29N3O4/c1-26-17-10-15(11-18(12-17)27-2)20(25)23-8-5-14(6-9-23)19(24)22-16-4-3-7-21-13-16/h10-12,14,16,21H,3-9,13H2,1-2H3,(H,22,24)
InChIKeyDJYCYOCTQKAKIV-UHFFFAOYSA-N
MW375.47 g/mol
LogP1.42
Rot. Bonds5

About 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide

1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide (PubChem CID 119427113) has the molecular formula C20H29N3O4 and a molecular weight of 375.47 g/mol. Its IUPAC name is 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide
PubChem CID119427113
Molecular FormulaC20H29N3O4
Molecular Weight375.47 g/mol
Exact Mass375.22
IUPAC Name1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide
SMILESCOc1cc(OC)cc(C(=O)N2CCC(C(=O)NC3CCCNC3)CC2)c1
InChIInChI=1S/C20H29N3O4/c1-26-17-10-15(11-18(12-17)27-2)20(25)23-8-5-14(6-9-23)19(24)22-16-4-3-7-21-13-16/h10-12,14,16,21H,3-9,13H2,1-2H3,(H,22,24)
InChIKeyDJYCYOCTQKAKIV-UHFFFAOYSA-N
XLogP1.42
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide
CID 113002527
3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119424226
N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]piperidine-3-carboxamide
CID 119330538
N-(2-adamantyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide
CID 78884210
1-(3,5-dimethoxybenzoyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)piperidine-4-carboxamide
CID 166227562
1-(3,5-dimethoxyphenyl)-5-oxo-N-piperidin-3-ylpyrrolidine-3-carboxamide
CID 119429326
N-cyclohexyl-1-[1-(3-methoxybenzoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 42693267
N-[(2S)-1-aminopropan-2-yl]-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide;hydrochloride
CID 120505350
1-(3,5-dimethoxybenzoyl)-N-[2-(ethylamino)ethyl]piperidine-4-carboxamide
CID 119507447
1-(3,5-dimethoxybenzoyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
CID 46471462
2-chloro-N-[1-(3,5-dimethoxybenzoyl)piperidin-4-yl]propanamide
CID 108564100
[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-pyrrolidin-2-ylmethanone
CID 119282011

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide (CID 119427113) is 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide is COc1cc(OC)cc(C(=O)N2CCC(C(=O)NC3CCCNC3)CC2)c1.
What is the InChIKey of 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide?
The InChIKey is DJYCYOCTQKAKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O4/c1-26-17-10-15(11-18(12-17)27-2)20(25)23-8-5-14(6-9-23)19(24)22-16-4-3-7-21-13-16/h10-12,14,16,21H,3-9,13H2,1-2H3,(H,22,24).
What are the key properties of 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide?
1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide is sourced from PubChem (CID 119427113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).