N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine

C12H18N4O2 — CID 55136076

IUPACN-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(NC(C2CC2)C2CC2)nc(OC)n1
InChIInChI=1S/C12H18N4O2/c1-17-11-14-10(15-12(16-11)18-2)13-9(7-3-4-7)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,13,14,15,16)
InChIKeyGSHLZMXBJAELJC-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.49
Rot. Bonds6

About N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine

N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine (PubChem CID 55136076) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
PubChem CID55136076
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(NC(C2CC2)C2CC2)nc(OC)n1
InChIInChI=1S/C12H18N4O2/c1-17-11-14-10(15-12(16-11)18-2)13-9(7-3-4-7)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,13,14,15,16)
InChIKeyGSHLZMXBJAELJC-UHFFFAOYSA-N
XLogP1.49
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(dicyclopropylmethyl)-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
CID 80897026
N-(dicyclopropylmethyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 112691713
N-(1-cyclohexylpropyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 63541208
N-(dicyclopropylmethyl)-4,6-dimethylpyrimidin-2-amine
CID 60732520
4-chloro-N-(dicyclopropylmethyl)-6-propoxy-1,3,5-triazin-2-amine
CID 62865328
2-N-(1-cyclohexylethyl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80827053
2-N-(dicyclopropylmethyl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 133333792
N-cyclooctyl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62859800
N-cyclohexyl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 15184090
N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80907357
(4-cyclohexyloxy-6-methoxy-1,3,5-triazin-2-yl)hydrazine
CID 80910649
N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62859814

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine (CID 55136076) is N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine is COc1nc(NC(C2CC2)C2CC2)nc(OC)n1.
What is the InChIKey of N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The InChIKey is GSHLZMXBJAELJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-17-11-14-10(15-12(16-11)18-2)13-9(7-3-4-7)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,13,14,15,16).
What are the key properties of N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine has a molecular weight of 250.30 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 55136076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).