N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide

C19H24N4O3 — CID 53335594

IUPACN-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide
SMILESCOCCNC(=O)c1ccc(Oc2nccnc2N2CCCCC2)cc1
InChIInChI=1S/C19H24N4O3/c1-25-14-11-21-18(24)15-5-7-16(8-6-15)26-19-17(20-9-10-22-19)23-12-3-2-4-13-23/h5-10H,2-4,11-14H2,1H3,(H,21,24)
InChIKeyTWVPECRJWSUCRK-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.64
Rot. Bonds7

About N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide

N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide (PubChem CID 53335594) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide
PubChem CID53335594
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide
SMILESCOCCNC(=O)c1ccc(Oc2nccnc2N2CCCCC2)cc1
InChIInChI=1S/C19H24N4O3/c1-25-14-11-21-18(24)15-5-7-16(8-6-15)26-19-17(20-9-10-22-19)23-12-3-2-4-13-23/h5-10H,2-4,11-14H2,1H3,(H,21,24)
InChIKeyTWVPECRJWSUCRK-UHFFFAOYSA-N
XLogP2.64
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(3-piperidin-1-ylpyrazin-2-yl)oxy-N-propylbenzamide
CID 53335585
4-(3-piperidin-1-ylpyrazin-2-yl)oxy-N-prop-2-enylbenzamide
CID 53335593
4-(3-pyrrolidin-1-ylpyrazin-2-yl)oxybenzoic acid
CID 45031060
N-[(1S)-1-(4-fluorophenyl)ethyl]-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide
CID 95185906
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide
CID 95185907
N-(3-methoxypropyl)-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide
CID 46392077
N-cycloheptyl-4-(3-morpholin-4-ylpyrazin-2-yl)oxybenzamide
CID 53335650
N-cyclohexyl-4-(3-thiomorpholin-4-ylpyrazin-2-yl)oxybenzamide
CID 53335611
N-[(4-methylphenyl)methyl]-4-[3-(4-methylpiperidin-1-yl)pyrazin-2-yl]oxybenzamide
CID 46394298
4-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836236
4-(3-morpholin-4-ylpyrazin-2-yl)oxy-N-phenylbenzamide
CID 53335632
4-[4-(aminomethyl)pyrimidin-2-yl]oxy-N-(2-methoxyethyl)benzamide
CID 153325332

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide?
The IUPAC name of N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide (CID 53335594) is N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide?
The canonical SMILES for N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide is COCCNC(=O)c1ccc(Oc2nccnc2N2CCCCC2)cc1.
What is the InChIKey of N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide?
The InChIKey is TWVPECRJWSUCRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-25-14-11-21-18(24)15-5-7-16(8-6-15)26-19-17(20-9-10-22-19)23-12-3-2-4-13-23/h5-10H,2-4,11-14H2,1H3,(H,21,24).
What are the key properties of N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide?
N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide has a molecular weight of 356.43 g/mol, XLogP of 2.64, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide is sourced from PubChem (CID 53335594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).