2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

C10H20N6 — CID 80774603

IUPAC2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(c1nc(N)nc(N(C)C)n1)C(C)C
InChIInChI=1S/C10H20N6/c1-6-16(7(2)3)10-13-8(11)12-9(14-10)15(4)5/h7H,6H2,1-5H3,(H2,11,12,13,14)
InChIKeyPDDWFHSTEWVUNT-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.75
Rot. Bonds4

About 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80774603) has the molecular formula C10H20N6 and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
PubChem CID80774603
Molecular FormulaC10H20N6
Molecular Weight224.31 g/mol
Exact Mass224.17
IUPAC Name2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(c1nc(N)nc(N(C)C)n1)C(C)C
InChIInChI=1S/C10H20N6/c1-6-16(7(2)3)10-13-8(11)12-9(14-10)15(4)5/h7H,6H2,1-5H3,(H2,11,12,13,14)
InChIKeyPDDWFHSTEWVUNT-UHFFFAOYSA-N
XLogP0.75
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

2-N,4-N,4-N-trimethyl-2-N-(4-methylpentan-2-yl)-1,3,5-triazine-2,4,6-triamine
CID 80810743
2-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 53431514
2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-2-N-pentan-3-yl-1,3,5-triazine-2,4,6-triamine
CID 80820612
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-propan-2-ylamino]acetamide
CID 80805910
2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 80820823
2-N-butan-2-yl-6-chloro-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 55125314
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-ethylamino]ethanol
CID 80791325
6-butan-2-yloxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80866087
(2S)-3-[[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-ethylamino]-2-methylpropanenitrile
CID 98870035
4-N-ethyl-4-N-propan-2-ylpyrimidine-2,4,6-triamine
CID 80775843
2-N-cyclopropyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine
CID 80774808
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-ethylamino]-N,N-dimethylacetamide
CID 80809834

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (CID 80774603) is 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is CCN(c1nc(N)nc(N(C)C)n1)C(C)C.
What is the InChIKey of 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is PDDWFHSTEWVUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N6/c1-6-16(7(2)3)10-13-8(11)12-9(14-10)15(4)5/h7H,6H2,1-5H3,(H2,11,12,13,14).
What are the key properties of 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 224.31 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80774603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).