4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine

C18H24N6O — CID 161423330

IUPAC4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESc1ccc(Cc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C18H24N6O/c1-2-4-15(5-3-1)14-16-20-17(23-8-6-19-7-9-23)22-18(21-16)24-10-12-25-13-11-24/h1-5,19H,6-14H2
InChIKeyVXAHPYQHFOJAAK-UHFFFAOYSA-N
MW340.43 g/mol
LogP0.71
Rot. Bonds4

About 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine

4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine (PubChem CID 161423330) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine
PubChem CID161423330
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESc1ccc(Cc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C18H24N6O/c1-2-4-15(5-3-1)14-16-20-17(23-8-6-19-7-9-23)22-18(21-16)24-10-12-25-13-11-24/h1-5,19H,6-14H2
InChIKeyVXAHPYQHFOJAAK-UHFFFAOYSA-N
XLogP0.71
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-benzyl-6-phenyl-1,3,5-triazin-2-yl)morpholine
CID 46854232
1-(4-benzylphenyl)piperazine
CID 4738749
5-benzyl-2-piperazin-1-ylpyrimidine;hydron;chloride
CID 118022265
4-[4-(4-benzylpiperazin-1-yl)-6-chloro-1,3,5-triazin-2-yl]morpholine
CID 10619455
4-(4-benzylphenyl)morpholine
CID 11514364
4-[4-[(2-methylquinolin-6-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
CID 161001109
4-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)morpholine
CID 141367198
5-benzyl-4-methyl-2-piperazin-1-ylpyrimidine;hydrochloride
CID 170986684
2-benzyl-4-piperazin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine
CID 14878806
5-[[4-[[4-[[4-[(3-carboxyphenyl)diazenyl]phenyl]methyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]methyl]phenyl]diazenyl]benzene-1,3-dicarboxylic acid
CID 158487848
4-[5-(2-phenylethyl)pyrimidin-2-yl]morpholine
CID 138973898
N-[(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]aniline
CID 67036409

Frequently Asked Questions

What is the IUPAC name of 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine (CID 161423330) is 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine is c1ccc(Cc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1.
What is the InChIKey of 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine?
The InChIKey is VXAHPYQHFOJAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-2-4-15(5-3-1)14-16-20-17(23-8-6-19-7-9-23)22-18(21-16)24-10-12-25-13-11-24/h1-5,19H,6-14H2.
What are the key properties of 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine?
4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine has a molecular weight of 340.43 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 161423330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).