6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

C10H20N6 — CID 551357

IUPAC6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCC(C)CC(N)c1nc(N)nc(N(C)C)n1
InChIInChI=1S/C10H20N6/c1-6(2)5-7(11)8-13-9(12)15-10(14-8)16(3)4/h6-7H,5,11H2,1-4H3,(H2,12,13,14,15)
InChIKeyNCJZJAHZUIBTNS-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.57
Rot. Bonds4

About 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 551357) has the molecular formula C10H20N6 and a molecular weight of 224.31 g/mol. Its IUPAC name is 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID551357
Molecular FormulaC10H20N6
Molecular Weight224.31 g/mol
Exact Mass224.17
IUPAC Name6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCC(C)CC(N)c1nc(N)nc(N(C)C)n1
InChIInChI=1S/C10H20N6/c1-6(2)5-7(11)8-13-9(12)15-10(14-8)16(3)4/h6-7H,5,11H2,1-4H3,(H2,12,13,14,15)
InChIKeyNCJZJAHZUIBTNS-UHFFFAOYSA-N
XLogP0.57
TPSA93.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

s-Triazine, 2,4-bis(isopropylamino)-6-propyl-
CID 33411
s-Triazine, 2-amino-4-(cyclohexylamino)-6-isopropyl-
CID 207482
6-(3-methylbutyl)-2-N,4-N-bis(2-methylpropyl)-1,3,5-triazine-2,4-diamine
CID 44370889
2-N,2-N-dimethyl-6-[(3-methylpiperidin-1-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 17449838
2-N,2-N-dimethyl-6-propan-2-yl-4-N-[(3S)-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-1,3,5-triazine-2,4-diamine
CID 171358992
6-(2-fluoropropan-2-yl)-2-N-(2-methylpentan-3-yl)-1,3,5-triazine-2,4-diamine
CID 18769876
6-(2-fluoropropan-2-yl)-2-N-(6-methylheptan-2-yl)-1,3,5-triazine-2,4-diamine
CID 18769881
6-(2-fluoropropan-2-yl)-2-N-(4-methylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 18769924
2-N-(1-cyclopropyl-2-methylpropyl)-6-(1-fluoroethyl)-1,3,5-triazine-2,4-diamine
CID 57536777
2-N-[(1S)-1-cyclopropyl-2-methylpropyl]-6-[(1R)-1-fluoroethyl]-1,3,5-triazine-2,4-diamine
CID 66901948
6-(2-fluoropropan-2-yl)-2-N-(5-methylhexan-3-yl)-1,3,5-triazine-2,4-diamine
CID 139833185
6-(1-fluoroethyl)-2-N-(3-methylbutan-2-yl)-1,3,5-triazine-2,4-diamine
CID 139833188

Frequently Asked Questions

What is the IUPAC name of 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 551357) is 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is CC(C)CC(N)c1nc(N)nc(N(C)C)n1.
What is the InChIKey of 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is NCJZJAHZUIBTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N6/c1-6(2)5-7(11)8-13-9(12)15-10(14-8)16(3)4/h6-7H,5,11H2,1-4H3,(H2,12,13,14,15).
What are the key properties of 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 224.31 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-amino-3-methylbutyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 551357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).