4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine

C20H30N8 — CID 70815484

IUPAC4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine
SMILESCCc1nc(Nc2ncccc2C2CCCN2C)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C20H30N8/c1-4-17-22-19(25-20(23-17)28-13-11-26(2)12-14-28)24-18-15(7-5-9-21-18)16-8-6-10-27(16)3/h5,7,9,16H,4,6,8,10-14H2,1-3H3,(H,21,22,23,24,25)
InChIKeyKENSWGIXDHSQMJ-UHFFFAOYSA-N
MW382.52 g/mol
LogP2.09
Rot. Bonds5

About 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine

4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine (PubChem CID 70815484) has the molecular formula C20H30N8 and a molecular weight of 382.52 g/mol. Its IUPAC name is 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine
PubChem CID70815484
Molecular FormulaC20H30N8
Molecular Weight382.52 g/mol
Exact Mass382.26
IUPAC Name4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine
SMILESCCc1nc(Nc2ncccc2C2CCCN2C)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C20H30N8/c1-4-17-22-19(25-20(23-17)28-13-11-26(2)12-14-28)24-18-15(7-5-9-21-18)16-8-6-10-27(16)3/h5,7,9,16H,4,6,8,10-14H2,1-3H3,(H,21,22,23,24,25)
InChIKeyKENSWGIXDHSQMJ-UHFFFAOYSA-N
XLogP2.09
TPSA73.31 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.52
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-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

N-(3-benzyl-2-pyridinyl)-4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 70815563
2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2-fluoro-6-methylphenyl)pyridine-3-carboxamide
CID 71234216
N-(2-cyclopropyl-6-pyridin-2-ylpyrimidin-4-yl)-4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 70816165
N-[6-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 70815764
4-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carbonitrile
CID 70815876
N-[5-(2-chlorophenyl)pyrimidin-4-yl]-4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 70816321
N-[4-(4-chlorophenyl)pyrimidin-2-yl]-4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 70815698
2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]pyridine-4-carboxamide
CID 70816172
N-[6-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-3-pyridinyl]benzamide
CID 70815466
6-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-phenylpyridine-2-carboxamide
CID 70816129
2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(4-methylphenyl)pyridine-4-carboxamide
CID 70815864
2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-prop-2-enylpyridine-4-carboxamide
CID 88995125

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine (CID 70815484) is 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine is CCc1nc(Nc2ncccc2C2CCCN2C)nc(N2CCN(C)CC2)n1.
What is the InChIKey of 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The InChIKey is KENSWGIXDHSQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N8/c1-4-17-22-19(25-20(23-17)28-13-11-26(2)12-14-28)24-18-15(7-5-9-21-18)16-8-6-10-27(16)3/h5,7,9,16H,4,6,8,10-14H2,1-3H3,(H,21,22,23,24,25).
What are the key properties of 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine?
4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine has a molecular weight of 382.52 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(4-methylpiperazin-1-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 70815484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).