2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

C19H22N6 — CID 155667011

IUPAC2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)Nc1nc(Nc2ccccc2)nc(N(C)c2ccccc2)n1
InChIInChI=1S/C19H22N6/c1-14(2)20-17-22-18(21-15-10-6-4-7-11-15)24-19(23-17)25(3)16-12-8-5-9-13-16/h4-14H,1-3H3,(H2,20,21,22,23,24)
InChIKeyGKIFZWINMJTQKF-UHFFFAOYSA-N
MW334.43 g/mol
LogP4.20
Rot. Bonds6

About 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (PubChem CID 155667011) has the molecular formula C19H22N6 and a molecular weight of 334.43 g/mol. Its IUPAC name is 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
PubChem CID155667011
Molecular FormulaC19H22N6
Molecular Weight334.43 g/mol
Exact Mass334.19
IUPAC Name2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)Nc1nc(Nc2ccccc2)nc(N(C)c2ccccc2)n1
InChIInChI=1S/C19H22N6/c1-14(2)20-17-22-18(21-15-10-6-4-7-11-15)24-19(23-17)25(3)16-12-8-5-9-13-16/h4-14H,1-3H3,(H2,20,21,22,23,24)
InChIKeyGKIFZWINMJTQKF-UHFFFAOYSA-N
XLogP4.20
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.43
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (CID 155667011) is 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is CC(C)Nc1nc(Nc2ccccc2)nc(N(C)c2ccccc2)n1.
What is the InChIKey of 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is GKIFZWINMJTQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6/c1-14(2)20-17-22-18(21-15-10-6-4-7-11-15)24-19(23-17)25(3)16-12-8-5-9-13-16/h4-14H,1-3H3,(H2,20,21,22,23,24).
What are the key properties of 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 334.43 g/mol, XLogP of 4.20, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N,6-N-diphenyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 155667011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).