N-(4-methoxyphenyl)-1,2,4-triazin-3-amine

C10H10N4O — CID 130015647

IUPACN-(4-methoxyphenyl)-1,2,4-triazin-3-amine
SMILESCOc1ccc(Nc2nccnn2)cc1
InChIInChI=1S/C10H10N4O/c1-15-9-4-2-8(3-5-9)13-10-11-6-7-12-14-10/h2-7H,1H3,(H,11,13,14)
InChIKeyLCEDXXQZZDJJBS-UHFFFAOYSA-N
MW202.22 g/mol
LogP1.62
Rot. Bonds3

About N-(4-methoxyphenyl)-1,2,4-triazin-3-amine

N-(4-methoxyphenyl)-1,2,4-triazin-3-amine (PubChem CID 130015647) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1,2,4-triazin-3-amine
PubChem CID130015647
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC NameN-(4-methoxyphenyl)-1,2,4-triazin-3-amine
SMILESCOc1ccc(Nc2nccnn2)cc1
InChIInChI=1S/C10H10N4O/c1-15-9-4-2-8(3-5-9)13-10-11-6-7-12-14-10/h2-7H,1H3,(H,11,13,14)
InChIKeyLCEDXXQZZDJJBS-UHFFFAOYSA-N
XLogP1.62
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-2-N,4-N-bis(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 23191
N-(4-methoxyphenyl)pyridazin-3-amine
CID 121218984
3-N-(4-methoxyphenyl)-5-N-(4-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112967421
4,6-dichloro-N-(4-methoxyphenyl)pyrimidin-2-amine
CID 10849619
2-N,4-N,6-N,8-N-tetrakis(4-methoxyphenyl)pyrimido[5,4-d]pyrimidine-2,4,6,8-tetramine
CID 15629175
5-N-cycloheptyl-3-N-(4-methoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112959185
3-N-(4-methoxyphenyl)-5-N-quinolin-8-yl-1,2,4-triazine-3,5-diamine
CID 112967432
N-(4-methoxyphenyl)-4-(1-methylpyridin-1-ium-4-yl)pyrimidin-2-amine iodide
CID 14722187
4-N-(4-methoxyphenyl)pyridine-3,4-diamine
CID 13287152
3-N-(4-methoxyphenyl)pyridine-3,4-diamine
CID 13441292
4-[[4-(4-methoxyphenyl)pyrimidin-2-yl]amino]benzenesulfonamide
CID 11667571
N-(4-methoxyphenyl)-4-thiophen-2-ylpyrimidin-2-amine
CID 14346981

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1,2,4-triazin-3-amine?
The IUPAC name of N-(4-methoxyphenyl)-1,2,4-triazin-3-amine (CID 130015647) is N-(4-methoxyphenyl)-1,2,4-triazin-3-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-1,2,4-triazin-3-amine?
The canonical SMILES for N-(4-methoxyphenyl)-1,2,4-triazin-3-amine is COc1ccc(Nc2nccnn2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1,2,4-triazin-3-amine?
The InChIKey is LCEDXXQZZDJJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-15-9-4-2-8(3-5-9)13-10-11-6-7-12-14-10/h2-7H,1H3,(H,11,13,14).
What are the key properties of N-(4-methoxyphenyl)-1,2,4-triazin-3-amine?
N-(4-methoxyphenyl)-1,2,4-triazin-3-amine has a molecular weight of 202.22 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1,2,4-triazin-3-amine is sourced from PubChem (CID 130015647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).