2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine

C11H19N5O — CID 154114668

IUPAC2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(NCC(C)C)nc(NC2CC2)n1
InChIInChI=1S/C11H19N5O/c1-7(2)6-12-9-14-10(13-8-4-5-8)16-11(15-9)17-3/h7-8H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKeyYYFUIZAYDAJBDM-UHFFFAOYSA-N
MW237.31 g/mol
LogP1.52
Rot. Bonds6

About 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine

2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine (PubChem CID 154114668) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine
PubChem CID154114668
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(NCC(C)C)nc(NC2CC2)n1
InChIInChI=1S/C11H19N5O/c1-7(2)6-12-9-14-10(13-8-4-5-8)16-11(15-9)17-3/h7-8H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKeyYYFUIZAYDAJBDM-UHFFFAOYSA-N
XLogP1.52
TPSA71.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

Prometon
CID 4928
Atraton
CID 15359
Terbumeton
CID 36584
Secbumeton
CID 33443
Cyprazine
CID 24738
6-ethoxy-N2-ethyl-N4-(propan-2-yl)-1,3,5-triazine-2,4-diamine
CID 779529
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
1,3,5-Triazine-2,4-diamine, 6-chloro-N2-(1,2-dimethylpropyl)-N4-ethyl-
CID 56843875
[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
2-((4-(Ethylamino)-6-methoxy-1,3,5-triazin-2-yl)amino)-2-methylpropiononitrile
CID 89022

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine (CID 154114668) is 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine is COc1nc(NCC(C)C)nc(NC2CC2)n1.
What is the InChIKey of 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is YYFUIZAYDAJBDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-7(2)6-12-9-14-10(13-8-4-5-8)16-11(15-9)17-3/h7-8H,4-6H2,1-3H3,(H2,12,13,14,15,16).
What are the key properties of 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine?
2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 237.31 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-6-methoxy-4-N-(2-methylpropyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 154114668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).