2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine

C14H17N5O — CID 107855436

IUPAC2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NC2Cc3ccccc3C2)nc(OC)n1
InChIInChI=1S/C14H17N5O/c1-15-12-17-13(19-14(18-12)20-2)16-11-7-9-5-3-4-6-10(9)8-11/h3-6,11H,7-8H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyQBXXYBOZTGDNHA-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.50
Rot. Bonds4

About 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine

2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 107855436) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID107855436
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NC2Cc3ccccc3C2)nc(OC)n1
InChIInChI=1S/C14H17N5O/c1-15-12-17-13(19-14(18-12)20-2)16-11-7-9-5-3-4-6-10(9)8-11/h3-6,11H,7-8H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyQBXXYBOZTGDNHA-UHFFFAOYSA-N
XLogP1.50
TPSA71.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methoxy-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazine-2,4-diamine
CID 80822609
N-(2,3-dihydro-1H-inden-2-yl)-5-fluoro-4-methoxypyrimidin-2-amine
CID 135097043
4-N-(2,3-dihydro-1H-inden-2-yl)-5-fluoro-2-N-methylpyrimidine-2,4-diamine
CID 107855407
N-cyclooctyl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62859800
2-N-[(2-chlorophenyl)methyl]-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80785749
6-N-[(3-chlorophenyl)methyl]-4-N-(2,3-dihydro-1H-inden-2-yl)-2-N-methoxy-1,3,5-triazine-2,4,6-triamine
CID 134107698
4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine
CID 62858726
2-N-tert-butyl-4-N-cyclopropyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 163594071
methyl 4-[[[4-chloro-6-(2,3-dihydro-1H-inden-2-ylamino)-1,3,5-triazin-2-yl]amino]methyl]benzoate
CID 22478849
[2-[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]cyclohexyl]methanol
CID 106368227
3-[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-1-methylpyrrolidin-2-one
CID 106258670
2-N-(1-cyclohexylethyl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80827053

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine (CID 107855436) is 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine is CNc1nc(NC2Cc3ccccc3C2)nc(OC)n1.
What is the InChIKey of 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is QBXXYBOZTGDNHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-15-12-17-13(19-14(18-12)20-2)16-11-7-9-5-3-4-6-10(9)8-11/h3-6,11H,7-8H2,1-2H3,(H2,15,16,17,18,19).
What are the key properties of 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine?
2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 271.32 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 107855436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).