2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine

C19H37N5 — CID 14933141

IUPAC2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine
SMILESCCCCN(CCCC)c1ncnc(N(CCCC)CCCC)n1
InChIInChI=1S/C19H37N5/c1-5-9-13-23(14-10-6-2)18-20-17-21-19(22-18)24(15-11-7-3)16-12-8-4/h17H,5-16H2,1-4H3
InChIKeyHALGYRUTFMQTNR-UHFFFAOYSA-N
MW335.54 g/mol
LogP4.68
Rot. Bonds14

About 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine

2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine (PubChem CID 14933141) has the molecular formula C19H37N5 and a molecular weight of 335.54 g/mol. Its IUPAC name is 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine
PubChem CID14933141
Molecular FormulaC19H37N5
Molecular Weight335.54 g/mol
Exact Mass335.30
IUPAC Name2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine
SMILESCCCCN(CCCC)c1ncnc(N(CCCC)CCCC)n1
InChIInChI=1S/C19H37N5/c1-5-9-13-23(14-10-6-2)18-20-17-21-19(22-18)24(15-11-7-3)16-12-8-4/h17H,5-16H2,1-4H3
InChIKeyHALGYRUTFMQTNR-UHFFFAOYSA-N
XLogP4.68
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.54
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine (CID 14933141) is 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine is CCCCN(CCCC)c1ncnc(N(CCCC)CCCC)n1.
What is the InChIKey of 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine?
The InChIKey is HALGYRUTFMQTNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37N5/c1-5-9-13-23(14-10-6-2)18-20-17-21-19(22-18)24(15-11-7-3)16-12-8-4/h17H,5-16H2,1-4H3.
What are the key properties of 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine?
2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine has a molecular weight of 335.54 g/mol, XLogP of 4.68, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N,4-N-tetrabutyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 14933141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).