N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine

C24H30N6O — CID 123975040

IUPACN-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine
SMILESCC1CNCCC1CNc1nc(-c2ccc(N3CCOCC3)cc2)cc2nccnc12
InChIInChI=1S/C24H30N6O/c1-17-15-25-7-6-19(17)16-28-24-23-22(26-8-9-27-23)14-21(29-24)18-2-4-20(5-3-18)30-10-12-31-13-11-30/h2-5,8-9,14,17,19,25H,6-7,10-13,15-16H2,1H3,(H,28,29)
InChIKeyICKRNBKWRPIZLS-UHFFFAOYSA-N
MW418.55 g/mol
LogP3.19
Rot. Bonds5

About N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine

N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine (PubChem CID 123975040) has the molecular formula C24H30N6O and a molecular weight of 418.55 g/mol. Its IUPAC name is N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine.

Molecular Properties

Compound NameN-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine
PubChem CID123975040
Molecular FormulaC24H30N6O
Molecular Weight418.55 g/mol
Exact Mass418.25
IUPAC NameN-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine
SMILESCC1CNCCC1CNc1nc(-c2ccc(N3CCOCC3)cc2)cc2nccnc12
InChIInChI=1S/C24H30N6O/c1-17-15-25-7-6-19(17)16-28-24-23-22(26-8-9-27-23)14-21(29-24)18-2-4-20(5-3-18)30-10-12-31-13-11-30/h2-5,8-9,14,17,19,25H,6-7,10-13,15-16H2,1H3,(H,28,29)
InChIKeyICKRNBKWRPIZLS-UHFFFAOYSA-N
XLogP3.19
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.55
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine with MolForge

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Related Compounds

N-(morpholin-2-ylmethyl)-7-(4-piperazin-1-ylphenyl)pyrido[3,4-b]pyrazin-5-amine
CID 163569241
1-[4-[4-[5-[[(2S)-morpholin-2-yl]methylamino]pyrido[3,4-b]pyrazin-7-yl]phenyl]piperazin-1-yl]propan-1-one
CID 71113790
7-(3-methyl-4-morpholin-4-ylphenyl)-N-[[(3R)-piperidin-3-yl]methyl]pyrido[3,4-b]pyrazin-5-amine
CID 71113342
7-[4-(4-methylpiperazin-1-yl)phenyl]-N-(thiomorpholin-2-ylmethyl)pyrido[3,4-b]pyrazin-5-amine
CID 71113358
2-methoxy-1-[4-[4-[5-(morpholin-2-ylmethylamino)pyrido[3,4-b]pyrazin-7-yl]phenyl]piperazin-1-yl]ethanone
CID 78012361
3-[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]propan-1-ol
CID 71113456
1-[(2R)-2-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]morpholin-4-yl]ethanone
CID 71113527
N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride
CID 66555381
2-[1-[4-[5-(morpholin-2-ylmethylamino)pyrido[3,4-b]pyrazin-7-yl]phenyl]piperidin-4-yl]oxyethanol
CID 78012294
N-methyl-2-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]morpholine-4-carboxamide
CID 78012348
CID 161049361
CID 161049361
tert-butyl 3-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]piperidine-1-carboxylate
CID 71113692

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The IUPAC name of N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine (CID 123975040) is N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine.
What is the SMILES notation for N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The canonical SMILES for N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine is CC1CNCCC1CNc1nc(-c2ccc(N3CCOCC3)cc2)cc2nccnc12.
What is the InChIKey of N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The InChIKey is ICKRNBKWRPIZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O/c1-17-15-25-7-6-19(17)16-28-24-23-22(26-8-9-27-23)14-21(29-24)18-2-4-20(5-3-18)30-10-12-31-13-11-30/h2-5,8-9,14,17,19,25H,6-7,10-13,15-16H2,1H3,(H,28,29).
What are the key properties of N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine?
N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine has a molecular weight of 418.55 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylpiperidin-4-yl)methyl]-7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-amine is sourced from PubChem (CID 123975040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).