[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol

C18H19N5O — CID 155515769

IUPAC[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol
SMILESNc1nc(NCCc2ccccc2)nc(-c2ccccc2CO)n1
InChIInChI=1S/C18H19N5O/c19-17-21-16(15-9-5-4-8-14(15)12-24)22-18(23-17)20-11-10-13-6-2-1-3-7-13/h1-9,24H,10-12H2,(H3,19,20,21,22,23)
InChIKeyVCCOJKMWNUULAK-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.27
Rot. Bonds6

About [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol

[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol (PubChem CID 155515769) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol
PubChem CID155515769
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC Name[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol
SMILESNc1nc(NCCc2ccccc2)nc(-c2ccccc2CO)n1
InChIInChI=1S/C18H19N5O/c19-17-21-16(15-9-5-4-8-14(15)12-24)22-18(23-17)20-11-10-13-6-2-1-3-7-13/h1-9,24H,10-12H2,(H3,19,20,21,22,23)
InChIKeyVCCOJKMWNUULAK-UHFFFAOYSA-N
XLogP2.27
TPSA96.95 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol 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

Ogerin
CID 56707820
Ogerin negative control
CID 39791182
4-(cyclohexylamino)-6-[[(2R)-2-hydroxy-2-phenylethyl]amino]-1,3,5-triazine-2-carbonitrile
CID 134135239
[2-[4-Amino-6-[(4-chlorophenyl)methylamino]-1,3,5-triazin-2-yl]phenyl]methanol
CID 155511832
[2-[4-Amino-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-4-chlorophenyl]methanol
CID 155531067
[2-[4-Amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]-4-chlorophenyl]methanol
CID 155558626
2-[3-[4-[2-(4-Fluorophenyl)ethylamino]-6-methoxy-1,3,5-triazin-2-yl]phenyl]propan-2-ol
CID 71599448
3-[3-[4-[2-(4-Fluorophenyl)ethylamino]-6-methoxy-1,3,5-triazin-2-yl]phenyl]pentan-3-ol
CID 71599623
[3-[4,6-bis[[(1R)-1-cyclopropylethyl]amino]-1,3,5-triazin-2-yl]phenyl]methanol
CID 117817092
2-[2-Fluoro-5-[4-[2-(4-fluorophenyl)ethylamino]-6-methoxy-1,3,5-triazin-2-yl]phenyl]propan-2-ol
CID 118986952
4-[2-[[4-(5-Aminopentylamino)-6-(4-fluorophenyl)-1,3,5-triazin-2-yl]amino]ethyl]phenol
CID 46232025
4-[2-[[4-(5-Aminopentylamino)-6-(3-fluorophenyl)-1,3,5-triazin-2-yl]amino]ethyl]phenol
CID 46232026

Frequently Asked Questions

What is the IUPAC name of [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol?
The IUPAC name of [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol (CID 155515769) is [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol.
What is the SMILES notation for [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol?
The canonical SMILES for [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol is Nc1nc(NCCc2ccccc2)nc(-c2ccccc2CO)n1.
What is the InChIKey of [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol?
The InChIKey is VCCOJKMWNUULAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c19-17-21-16(15-9-5-4-8-14(15)12-24)22-18(23-17)20-11-10-13-6-2-1-3-7-13/h1-9,24H,10-12H2,(H3,19,20,21,22,23).
What are the key properties of [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol?
[2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol has a molecular weight of 321.38 g/mol, XLogP of 2.27, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-amino-6-(2-phenylethylamino)-1,3,5-triazin-2-yl]phenyl]methanol is sourced from PubChem (CID 155515769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).