4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine

C16H27N5O2 — CID 11771603

IUPAC4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
SMILESCC[C@H](C)Cc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H27N5O2/c1-3-13(2)12-14-17-15(20-4-8-22-9-5-20)19-16(18-14)21-6-10-23-11-7-21/h13H,3-12H2,1-2H3/t13-/m0/s1
InChIKeyHNGNCTMDRAEDNG-ZDUSSCGKSA-N
MW321.43 g/mol
LogP1.13
Rot. Bonds5

About 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine

4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine (PubChem CID 11771603) has the molecular formula C16H27N5O2 and a molecular weight of 321.43 g/mol. Its IUPAC name is 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
PubChem CID11771603
Molecular FormulaC16H27N5O2
Molecular Weight321.43 g/mol
Exact Mass321.22
IUPAC Name4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
SMILESCC[C@H](C)Cc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H27N5O2/c1-3-13(2)12-14-17-15(20-4-8-22-9-5-20)19-16(18-14)21-6-10-23-11-7-21/h13H,3-12H2,1-2H3/t13-/m0/s1
InChIKeyHNGNCTMDRAEDNG-ZDUSSCGKSA-N
XLogP1.13
TPSA63.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine 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

4-(4-Morpholinyl)-6-(1-piperidinyl)-1,3,5-triazine-2-carbonitrile
CID 729563
s-Triazine, 2-amino-4-morpholino-6-(piperidinomethyl)-
CID 210895
s-Triazine, 2-amino-4-(morpholinomethyl)-6-piperidino-
CID 210896
s-Triazine, 2,4-dimorpholino-6-methyl-
CID 33387
4-(4-Morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-yl)morpholine
CID 44396454
1,3,5-Triazine, 2-ethyl-4-methoxy-6-(4-morpholinyl)-
CID 199903
2-(4-Methyl-1-piperidinyl)-4,6-di(4-morpholinyl)-1,3,5-triazine
CID 683320
3-(4,6-Dimorpholin-4-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)-2,3,4,5-tetrahydropyridin-6-amine
CID 137699132
4-(4-Hex-1-ynyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine
CID 11267551
4-Morpholin-4-yl-6-pentyl-1,3,5-triazin-2-amine
CID 22166508
4-(1-Methylsulfonylpiperidin-4-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 66698051
4-(4-Methyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
CID 89903045

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The IUPAC name of 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine (CID 11771603) is 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine.
What is the SMILES notation for 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The canonical SMILES for 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine is CC[C@H](C)Cc1nc(N2CCOCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The InChIKey is HNGNCTMDRAEDNG-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H27N5O2/c1-3-13(2)12-14-17-15(20-4-8-22-9-5-20)19-16(18-14)21-6-10-23-11-7-21/h13H,3-12H2,1-2H3/t13-/m0/s1.
What are the key properties of 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine has a molecular weight of 321.43 g/mol, XLogP of 1.13, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(2S)-2-methylbutyl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine is sourced from PubChem (CID 11771603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).