2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol

C18H26N6O2 — CID 5112726

IUPAC2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCC(C)c1ccc(Nc2nc(NCCO)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C18H26N6O2/c1-13(2)14-3-5-15(6-4-14)20-17-21-16(19-7-10-25)22-18(23-17)24-8-11-26-12-9-24/h3-6,13,25H,7-12H2,1-2H3,(H2,19,20,21,22,23)
InChIKeyHPMUYQMUHRHGNY-UHFFFAOYSA-N
MW358.45 g/mol
LogP1.98
Rot. Bonds7

About 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol

2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 5112726) has the molecular formula C18H26N6O2 and a molecular weight of 358.45 g/mol. Its IUPAC name is 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID5112726
Molecular FormulaC18H26N6O2
Molecular Weight358.45 g/mol
Exact Mass358.21
IUPAC Name2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCC(C)c1ccc(Nc2nc(NCCO)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C18H26N6O2/c1-13(2)14-3-5-15(6-4-14)20-17-21-16(19-7-10-25)22-18(23-17)24-8-11-26-12-9-24/h3-6,13,25H,7-12H2,1-2H3,(H2,19,20,21,22,23)
InChIKeyHPMUYQMUHRHGNY-UHFFFAOYSA-N
XLogP1.98
TPSA95.43 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol with MolForge

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Related Compounds

4,6-dimorpholin-4-yl-N-(4-propan-2-ylphenyl)-1,3,5-triazin-2-amine;hydrochloride
CID 18580222
2-[[4-(diethylamino)-6-(4-morpholin-4-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol
CID 117093688
4-N-[2-(dimethylamino)ethyl]-6-morpholin-4-yl-2-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine
CID 171061531
ethyl (3S)-3-[[4-(2-hydroxyethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)propanoate
CID 42584005
ethyl 3-[[4-(2-hydroxyethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)propanoate
CID 3877386
2-N-(4-chlorophenyl)-4-N-(4-ethylphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 7192046
2-N-(3-chloro-4-methylphenyl)-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 18580181
2-N-(4-chlorophenyl)-4-N-(4-methoxyphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 42477743
6-morpholin-4-yl-2-N,4-N-bis(4-phenylphenyl)-1,3,5-triazine-2,4-diamine
CID 10074710
2-N-(4-methoxyphenyl)-6-morpholin-4-yl-4-N-prop-2-enyl-1,3,5-triazine-2,4-diamine
CID 3146893
4-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]benzoic acid
CID 4767474
1-[[4-morpholin-4-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-2-ol
CID 80773597

Frequently Asked Questions

What is the IUPAC name of 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol (CID 5112726) is 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol is CC(C)c1ccc(Nc2nc(NCCO)nc(N3CCOCC3)n2)cc1.
What is the InChIKey of 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is HPMUYQMUHRHGNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O2/c1-13(2)14-3-5-15(6-4-14)20-17-21-16(19-7-10-25)22-18(23-17)24-8-11-26-12-9-24/h3-6,13,25H,7-12H2,1-2H3,(H2,19,20,21,22,23).
What are the key properties of 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 358.45 g/mol, XLogP of 1.98, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-morpholin-4-yl-6-(4-propan-2-ylanilino)-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 5112726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).