N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide

C25H26N4O3 — CID 53166526

IUPACN-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nccnc2C(=O)N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C25H26N4O3/c1-32-21-9-7-20(8-10-21)24(30)28-23-22(26-13-14-27-23)25(31)29-15-11-19(12-16-29)17-18-5-3-2-4-6-18/h2-10,13-14,19H,11-12,15-17H2,1H3,(H,27,28,30)
InChIKeyFFLVJFQJUWAXSC-UHFFFAOYSA-N
MW430.51 g/mol
LogP3.83
Rot. Bonds6

About N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide

N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide (PubChem CID 53166526) has the molecular formula C25H26N4O3 and a molecular weight of 430.51 g/mol. Its IUPAC name is N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide
PubChem CID53166526
Molecular FormulaC25H26N4O3
Molecular Weight430.51 g/mol
Exact Mass430.20
IUPAC NameN-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nccnc2C(=O)N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C25H26N4O3/c1-32-21-9-7-20(8-10-21)24(30)28-23-22(26-13-14-27-23)25(31)29-15-11-19(12-16-29)17-18-5-3-2-4-6-18/h2-10,13-14,19H,11-12,15-17H2,1H3,(H,27,28,30)
InChIKeyFFLVJFQJUWAXSC-UHFFFAOYSA-N
XLogP3.83
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-benzylpiperidin-4-yl)-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866621
3-[(4-methoxybenzoyl)amino]-N-[1-(2-methoxybenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853875
N-[3-(azepane-1-carbonyl)pyrazin-2-yl]benzamide
CID 53166582
1-(4-benzylpiperidin-1-yl)-2-(4-methoxyphenoxy)ethanone
CID 740892
3-[4-[(3-methoxyphenyl)methyl]piperidine-1-carbonyl]pyrazine-2-carboxamide
CID 136530088
N-[1-(cyclohexylcarbamoyl)piperidin-4-yl]-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866717
4-(4-benzylpiperidine-1-carbonyl)-N-(3-methoxypropyl)benzamide
CID 109045307
methyl 3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxylate
CID 53485391
N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 46049068
N-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]pyrazin-2-yl]-4-methylbenzamide
CID 53166503
N-[4-(4-benzylpiperidine-1-carbonyl)thiadiazol-5-yl]-4-(4-methoxyphenyl)piperazine-1-carboxamide
CID 17037023
(4-benzylpiperidin-1-yl)-[2-(methylamino)-3-pyridinyl]methanone
CID 84575153

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide?
The IUPAC name of N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide (CID 53166526) is N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide.
What is the SMILES notation for N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide?
The canonical SMILES for N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2nccnc2C(=O)N2CCC(Cc3ccccc3)CC2)cc1.
What is the InChIKey of N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide?
The InChIKey is FFLVJFQJUWAXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3/c1-32-21-9-7-20(8-10-21)24(30)28-23-22(26-13-14-27-23)25(31)29-15-11-19(12-16-29)17-18-5-3-2-4-6-18/h2-10,13-14,19H,11-12,15-17H2,1H3,(H,27,28,30).
What are the key properties of N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide?
N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide has a molecular weight of 430.51 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-benzylpiperidine-1-carbonyl)pyrazin-2-yl]-4-methoxybenzamide is sourced from PubChem (CID 53166526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).