N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide

C24H28N6O2 — CID 83278309

IUPACN-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
SMILESO=C(NCc1ccc(N2CCOCC2)cc1)C1CCN(c2cnc3nccnc3c2)CC1
InChIInChI=1S/C24H28N6O2/c31-24(28-16-18-1-3-20(4-2-18)30-11-13-32-14-12-30)19-5-9-29(10-6-19)21-15-22-23(27-17-21)26-8-7-25-22/h1-4,7-8,15,17,19H,5-6,9-14,16H2,(H,28,31)
InChIKeyFIUNTUSFWDWLDR-UHFFFAOYSA-N
MW432.53 g/mol
LogP2.39
Rot. Bonds5

About N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide

N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide (PubChem CID 83278309) has the molecular formula C24H28N6O2 and a molecular weight of 432.53 g/mol. Its IUPAC name is N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
PubChem CID83278309
Molecular FormulaC24H28N6O2
Molecular Weight432.53 g/mol
Exact Mass432.23
IUPAC NameN-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
SMILESO=C(NCc1ccc(N2CCOCC2)cc1)C1CCN(c2cnc3nccnc3c2)CC1
InChIInChI=1S/C24H28N6O2/c31-24(28-16-18-1-3-20(4-2-18)30-11-13-32-14-12-30)19-5-9-29(10-6-19)21-15-22-23(27-17-21)26-8-7-25-22/h1-4,7-8,15,17,19H,5-6,9-14,16H2,(H,28,31)
InChIKeyFIUNTUSFWDWLDR-UHFFFAOYSA-N
XLogP2.39
TPSA83.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.53
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-[(4-morpholin-4-ylphenyl)methyl]cyclohexanecarboxamide
CID 110405120
N-[(2,5-dimethoxyphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
CID 71839287
1-benzyl-N-[(4-morpholin-4-ylphenyl)methyl]piperidine-4-carboxamide
CID 46774277
N-butan-2-yl-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
CID 71839302
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38792432
(3R)-1-(1-methyl-6-oxopyridazin-4-yl)-N-[(4-morpholin-4-ylphenyl)methyl]piperidine-3-carboxamide
CID 95115689
1-[(3-chlorophenyl)methylsulfonyl]-N-[(4-morpholin-4-ylphenyl)methyl]piperidine-4-carboxamide
CID 53283856
1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide
CID 53166089
(3S)-1-pyrido[2,3-b]pyrazin-7-yl-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 97416422
1-benzylsulfonyl-N-[(4-morpholin-4-ylphenyl)methyl]piperidine-4-carboxamide
CID 28636356
N-[(3-methoxyphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide
CID 71839369
N-[(4-chlorophenyl)methyl]-1-phenylpiperidine-4-carboxamide
CID 17152448

Frequently Asked Questions

What is the IUPAC name of N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide?
The IUPAC name of N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide (CID 83278309) is N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide is O=C(NCc1ccc(N2CCOCC2)cc1)C1CCN(c2cnc3nccnc3c2)CC1.
What is the InChIKey of N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide?
The InChIKey is FIUNTUSFWDWLDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O2/c31-24(28-16-18-1-3-20(4-2-18)30-11-13-32-14-12-30)19-5-9-29(10-6-19)21-15-22-23(27-17-21)26-8-7-25-22/h1-4,7-8,15,17,19H,5-6,9-14,16H2,(H,28,31).
What are the key properties of N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide?
N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide has a molecular weight of 432.53 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-morpholin-4-ylphenyl)methyl]-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide is sourced from PubChem (CID 83278309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).