N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine

C14H17N5 — CID 112941887

IUPACN-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine
SMILESc1ccc(Nc2nncc(N3CCCCC3)n2)cc1
InChIInChI=1S/C14H17N5/c1-3-7-12(8-4-1)16-14-17-13(11-15-18-14)19-9-5-2-6-10-19/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,16,17,18)
InChIKeyWJOSIQGELDAHGN-UHFFFAOYSA-N
MW255.33 g/mol
LogP2.61
Rot. Bonds3

About N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine

N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine (PubChem CID 112941887) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine
PubChem CID112941887
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC NameN-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine
SMILESc1ccc(Nc2nncc(N3CCCCC3)n2)cc1
InChIInChI=1S/C14H17N5/c1-3-7-12(8-4-1)16-14-17-13(11-15-18-14)19-9-5-2-6-10-19/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,16,17,18)
InChIKeyWJOSIQGELDAHGN-UHFFFAOYSA-N
XLogP2.61
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine 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

5-(4-methylpiperazin-1-yl)-N-phenyl-1,2,4-triazin-3-amine
CID 112945843
5-(azepan-1-yl)-N-(4-ethylphenyl)-1,2,4-triazin-3-amine
CID 112961261
5-(azepan-1-yl)-N-(2-bromophenyl)-1,2,4-triazin-3-amine
CID 112961320
1-[4-[(5-piperidin-1-yl-1,2,4-triazin-3-yl)amino]phenyl]ethanone
CID 112941941
N-(2-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine
CID 112941149
N-(2,6-dichlorophenyl)-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112941981
N-(3,4-difluorophenyl)-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112941993
methyl 4-[(5-piperidin-1-yl-1,2,4-triazin-3-yl)amino]benzoate
CID 112941946
N-(3,4-dimethylphenyl)-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine
CID 112941132
2-[[5-(azepan-1-yl)-1,2,4-triazin-3-yl]amino]benzonitrile
CID 112961346
5-(azepan-1-yl)-N-(2-phenylethyl)-1,2,4-triazin-3-amine
CID 112952983
N-(4-tert-butylphenyl)-5-(4-phenylpiperazin-1-yl)-1,2,4-triazin-3-amine
CID 112955475

Frequently Asked Questions

What is the IUPAC name of N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine?
The IUPAC name of N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine (CID 112941887) is N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine.
What is the SMILES notation for N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine?
The canonical SMILES for N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine is c1ccc(Nc2nncc(N3CCCCC3)n2)cc1.
What is the InChIKey of N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine?
The InChIKey is WJOSIQGELDAHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-3-7-12(8-4-1)16-14-17-13(11-15-18-14)19-9-5-2-6-10-19/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,16,17,18).
What are the key properties of N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine?
N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine has a molecular weight of 255.33 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine is sourced from PubChem (CID 112941887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).