4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine

C10H19N5O — CID 151886318

IUPAC4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOC(Cc1nc(C)nc(N)n1)CC(C)N
InChIInChI=1S/C10H19N5O/c1-6(11)4-8(16-3)5-9-13-7(2)14-10(12)15-9/h6,8H,4-5,11H2,1-3H3,(H2,12,13,14,15)
InChIKeySPTXNNJXOUXRNI-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.06
Rot. Bonds5

About 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine

4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine (PubChem CID 151886318) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine
PubChem CID151886318
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOC(Cc1nc(C)nc(N)n1)CC(C)N
InChIInChI=1S/C10H19N5O/c1-6(11)4-8(16-3)5-9-13-7(2)14-10(12)15-9/h6,8H,4-5,11H2,1-3H3,(H2,12,13,14,15)
InChIKeySPTXNNJXOUXRNI-UHFFFAOYSA-N
XLogP0.06
TPSA99.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine (CID 151886318) is 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine is COC(Cc1nc(C)nc(N)n1)CC(C)N.
What is the InChIKey of 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is SPTXNNJXOUXRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-6(11)4-8(16-3)5-9-13-7(2)14-10(12)15-9/h6,8H,4-5,11H2,1-3H3,(H2,12,13,14,15).
What are the key properties of 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine?
4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 225.30 g/mol, XLogP of 0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-2-methoxypentyl)-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 151886318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).