2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine

C12H23N5 — CID 164998487

IUPAC2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCCN(C)c1nc(C(C)C)nc(N(C)CC)n1
InChIInChI=1S/C12H23N5/c1-7-16(5)11-13-10(9(3)4)14-12(15-11)17(6)8-2/h9H,7-8H2,1-6H3
InChIKeyHWTYCZZSQUXXGR-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.91
Rot. Bonds5

About 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine

2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine (PubChem CID 164998487) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
PubChem CID164998487
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC Name2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCCN(C)c1nc(C(C)C)nc(N(C)CC)n1
InChIInChI=1S/C12H23N5/c1-7-16(5)11-13-10(9(3)4)14-12(15-11)17(6)8-2/h9H,7-8H2,1-6H3
InChIKeyHWTYCZZSQUXXGR-UHFFFAOYSA-N
XLogP1.91
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine (CID 164998487) is 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine is CCN(C)c1nc(C(C)C)nc(N(C)CC)n1.
What is the InChIKey of 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is HWTYCZZSQUXXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-7-16(5)11-13-10(9(3)4)14-12(15-11)17(6)8-2/h9H,7-8H2,1-6H3.
What are the key properties of 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 237.35 g/mol, XLogP of 1.91, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-diethyl-2-N,4-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 164998487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).