2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine

C14H25N7 — CID 58012607

IUPAC2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine
SMILESCc1nc(N2CCNC(C)C2)nc(N2CCNC(C)C2)n1
InChIInChI=1S/C14H25N7/c1-10-8-20(6-4-15-10)13-17-12(3)18-14(19-13)21-7-5-16-11(2)9-21/h10-11,15-16H,4-9H2,1-3H3
InChIKeyIYWHUIRZGUZOTH-UHFFFAOYSA-N
MW291.40 g/mol
LogP-0.22
Rot. Bonds2

About 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine

2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine (PubChem CID 58012607) has the molecular formula C14H25N7 and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine
PubChem CID58012607
Molecular FormulaC14H25N7
Molecular Weight291.40 g/mol
Exact Mass291.22
IUPAC Name2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine
SMILESCc1nc(N2CCNC(C)C2)nc(N2CCNC(C)C2)n1
InChIInChI=1S/C14H25N7/c1-10-8-20(6-4-15-10)13-17-12(3)18-14(19-13)21-7-5-16-11(2)9-21/h10-11,15-16H,4-9H2,1-3H3
InChIKeyIYWHUIRZGUZOTH-UHFFFAOYSA-N
XLogP-0.22
TPSA69.21 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine 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-methyl-2-[(3S)-3-methylpiperazin-1-yl]pyrimidine
CID 104977378
4,6-dimethoxy-2-[(3S)-3-methylpiperazin-1-yl]pyrimidine
CID 96913861
4-methoxy-6-methyl-2-[(3R)-3-methylpiperazin-1-yl]pyrimidine
CID 104976163
4-methyl-2-(3-methylpiperazin-1-yl)pyrimidine;hydrochloride
CID 71639412
5-bromo-4-methyl-2-[(3R)-3-methylpiperazin-1-yl]pyrimidine
CID 122620941
2-methyl-5-(3-methylpiperazin-1-yl)-1,3,4-thiadiazole
CID 65209428
2-methyl-4-[(3S)-3-methylpiperazin-1-yl]pyrimidine
CID 94586892
(3R)-1-(5-tert-butyl-1H-1,2,4-triazol-3-yl)-3-methylpiperazine
CID 102797674
5-iodo-2-(3-methylpiperazin-1-yl)pyrimidine
CID 116648329
3-methyl-6-(3-methylpiperazin-1-yl)pyridazine
CID 62478379
4-methyl-2-(3-methylpiperazin-1-yl)-1,3-thiazole
CID 62480503
2,5-dimethyl-3-[(3R)-3-methylpiperazin-1-yl]pyrazine
CID 94450674

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine?
The IUPAC name of 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine (CID 58012607) is 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine?
The canonical SMILES for 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine is Cc1nc(N2CCNC(C)C2)nc(N2CCNC(C)C2)n1.
What is the InChIKey of 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine?
The InChIKey is IYWHUIRZGUZOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N7/c1-10-8-20(6-4-15-10)13-17-12(3)18-14(19-13)21-7-5-16-11(2)9-21/h10-11,15-16H,4-9H2,1-3H3.
What are the key properties of 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine?
2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine has a molecular weight of 291.40 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,6-bis(3-methylpiperazin-1-yl)-1,3,5-triazine is sourced from PubChem (CID 58012607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).