2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine

C25H32N6O — CID 25204041

IUPAC2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine
SMILESCN1CCN(c2ccc(-c3cc(NCCN4CCOCC4)c4ncccc4n3)cc2)CC1
InChIInChI=1S/C25H32N6O/c1-29-11-13-31(14-12-29)21-6-4-20(5-7-21)23-19-24(25-22(28-23)3-2-8-27-25)26-9-10-30-15-17-32-18-16-30/h2-8,19H,9-18H2,1H3,(H,26,28)
InChIKeyXCPUECPCVDUJTJ-UHFFFAOYSA-N
MW432.57 g/mol
LogP2.79
Rot. Bonds6

About 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine

2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine (PubChem CID 25204041) has the molecular formula C25H32N6O and a molecular weight of 432.57 g/mol. Its IUPAC name is 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine.

Molecular Properties

Compound Name2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine
PubChem CID25204041
Molecular FormulaC25H32N6O
Molecular Weight432.57 g/mol
Exact Mass432.26
IUPAC Name2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine
SMILESCN1CCN(c2ccc(-c3cc(NCCN4CCOCC4)c4ncccc4n3)cc2)CC1
InChIInChI=1S/C25H32N6O/c1-29-11-13-31(14-12-29)21-6-4-20(5-7-21)23-19-24(25-22(28-23)3-2-8-27-25)26-9-10-30-15-17-32-18-16-30/h2-8,19H,9-18H2,1H3,(H,26,28)
InChIKeyXCPUECPCVDUJTJ-UHFFFAOYSA-N
XLogP2.79
TPSA56.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine with MolForge

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Related Compounds

3-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)quinolin-4-amine
CID 25204039
2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-7H-purin-6-amine
CID 71109457
5-chloro-7-[4-(4-methylpiperazin-1-yl)phenyl]-1,6-naphthyridine
CID 44816203
6-chloro-2-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)quinolin-4-amine
CID 91938165
4-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]quinoline;hydrochloride
CID 42887250
N-(2-morpholin-4-ylethyl)-2,6-diphenylpyrimidin-4-amine
CID 59340658
6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine
CID 112857696
7-(4-methylpiperazin-1-yl)-4-N,6-N-bis(2-morpholin-4-ylethyl)-2-phenylpteridine-4,6-diamine
CID 71111903
N-(2-morpholin-4-ylethyl)-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112857585
4-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-6-phenylpyrimidin-2-amine
CID 112935363
4-[4-(5-chloro-1,6-naphthyridin-7-yl)phenyl]morpholine;ethane
CID 143936489
4-[4-(3-methylphenyl)piperazin-1-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112887479

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine?
The IUPAC name of 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine (CID 25204041) is 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine.
What is the SMILES notation for 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine?
The canonical SMILES for 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine is CN1CCN(c2ccc(-c3cc(NCCN4CCOCC4)c4ncccc4n3)cc2)CC1.
What is the InChIKey of 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine?
The InChIKey is XCPUECPCVDUJTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N6O/c1-29-11-13-31(14-12-29)21-6-4-20(5-7-21)23-19-24(25-22(28-23)3-2-8-27-25)26-9-10-30-15-17-32-18-16-30/h2-8,19H,9-18H2,1H3,(H,26,28).
What are the key properties of 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine?
2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine has a molecular weight of 432.57 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(2-morpholin-4-ylethyl)-1,5-naphthyridin-4-amine is sourced from PubChem (CID 25204041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).