ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine

C11H20N4 — CID 145368095

IUPACethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
SMILESCC.CC.Cc1ccc2c(N)ncnn12
InChIInChI=1S/C7H8N4.2C2H6/c1-5-2-3-6-7(8)9-4-10-11(5)6;2*1-2/h2-4H,1H3,(H2,8,9,10);2*1-2H3
InChIKeyDKDKYMOPHCTMFH-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.67
Rot. Bonds

About ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine

ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine (PubChem CID 145368095) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine.

Molecular Properties

Compound Nameethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
PubChem CID145368095
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Nameethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
SMILESCC.CC.Cc1ccc2c(N)ncnn12
InChIInChI=1S/C7H8N4.2C2H6/c1-5-2-3-6-7(8)9-4-10-11(5)6;2*1-2/h2-4H,1H3,(H2,8,9,10);2*1-2H3
InChIKeyDKDKYMOPHCTMFH-UHFFFAOYSA-N
XLogP2.67
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-iodopyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 90176299
ethane;7-methylpyrrolo[2,1-f][1,2,4]triazine-2,4-diamine
CID 145368104
1-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)ethanol
CID 90397339
4-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)butan-1-ol
CID 58529282
1-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-chloroethanol
CID 143458596
7-bromo-5-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine;ethane
CID 145068521
(1R,3S,4S,5R)-3-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-4-fluoro-1-methyl-2-oxabicyclo[3.1.0]hexane-5,6-diol
CID 134177353
tert-butyl 2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)acetate
CID 166517927
7-(4-methoxy-2-methylpentan-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 143861213
7-(4-methylcyclohexen-1-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 131980519
7-bromoimidazo[2,1-f][1,2,4]triazin-4-amine;ethane
CID 145368007
8-methoxy-5-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 167686065

Frequently Asked Questions

What is the IUPAC name of ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The IUPAC name of ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine (CID 145368095) is ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine.
What is the SMILES notation for ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The canonical SMILES for ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine is CC.CC.Cc1ccc2c(N)ncnn12.
What is the InChIKey of ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
The InChIKey is DKDKYMOPHCTMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4.2C2H6/c1-5-2-3-6-7(8)9-4-10-11(5)6;2*1-2/h2-4H,1H3,(H2,8,9,10);2*1-2H3.
What are the key properties of ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine?
ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine has a molecular weight of 208.31 g/mol, XLogP of 2.67, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine is sourced from PubChem (CID 145368095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).