4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine

C8H14N4O2 — CID 2056051

IUPAC4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(OC)n1
InChIInChI=1S/C8H14N4O2/c1-4-5-9-6-10-7(13-2)12-8(11-6)14-3/h4-5H2,1-3H3,(H,9,10,11,12)
InChIKeyBYDPJUNIVPXOCF-UHFFFAOYSA-N
MW198.23 g/mol
LogP0.71
Rot. Bonds5

About 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine

4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine (PubChem CID 2056051) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
PubChem CID2056051
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(OC)n1
InChIInChI=1S/C8H14N4O2/c1-4-5-9-6-10-7(13-2)12-8(11-6)14-3/h4-5H2,1-3H3,(H,9,10,11,12)
InChIKeyBYDPJUNIVPXOCF-UHFFFAOYSA-N
XLogP0.71
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Prometon
CID 4928
Atraton
CID 15359
Terbumeton
CID 36584
Secbumeton
CID 33443
Simeton
CID 12654
6-ethoxy-N2-ethyl-N4-(propan-2-yl)-1,3,5-triazine-2,4-diamine
CID 779529
N-Butyl-1,3,5-triazine-2,4,6-triamine
CID 197831
6-Methoxy-N2-methyl-N4-(1-methylethyl)-1,3,5-triazine-2,4-diamine
CID 18212
2-Methoxy-4-isopropylamino-6-diethylamino-S-triazine
CID 18152
[4-(Butan-2-ylamino)-6-methoxy-1,3,5-triazin-2-yl]methylcyanamide
CID 657554
1,3,5-Triazine-2,4-diamine, N-ethyl-6-methoxy-N'-propyl-
CID 2173744
N-[4-(butylamino)-6-[hydroxy(methyl)amino]-1,3,5-triazin-2-yl]-N-methylhydroxylamine
CID 46226431

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine (CID 2056051) is 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine is CCCNc1nc(OC)nc(OC)n1.
What is the InChIKey of 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The InChIKey is BYDPJUNIVPXOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-4-5-9-6-10-7(13-2)12-8(11-6)14-3/h4-5H2,1-3H3,(H,9,10,11,12).
What are the key properties of 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine has a molecular weight of 198.23 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 2056051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).