4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C8H12ClN5O — CID 62869364

IUPAC4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C8H12ClN5O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H,10,11,12,13)
InChIKeyAFBPTIRLDGHXSR-UHFFFAOYSA-N
MW229.67 g/mol
LogP0.40
Rot. Bonds2

About 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 62869364) has the molecular formula C8H12ClN5O and a molecular weight of 229.67 g/mol. Its IUPAC name is 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID62869364
Molecular FormulaC8H12ClN5O
Molecular Weight229.67 g/mol
Exact Mass229.07
IUPAC Name4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C8H12ClN5O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H,10,11,12,13)
InChIKeyAFBPTIRLDGHXSR-UHFFFAOYSA-N
XLogP0.40
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.67
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,4-Dichloro-6-morpholino-1,3,5-triazine
CID 81076
2-N-tert-butyl-6-chloro-4-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 3762337
4-Methoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
CID 709353
6-(4-Morpholinyl)-1,3,5-triazine-2,4-diamine
CID 96906
4-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholinium chloride
CID 2734059
2-Chloro-4-methoxy-6-(morpholin-4-yl)-1,3,5-triazine
CID 686256
4-methoxy-N-methyl-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 976569
4,6-dimorpholin-4-yl-N-propyl-1,3,5-triazin-2-amine
CID 2057546
N,N,N',N'-tetramethyl-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine
CID 1508119
s-Triazine, 2,4-bis(methylamino)-6-morpholino-
CID 204412
4-Chloro-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
CID 13950063
6-Chloro-N4-[2-(morpholin-4-YL)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine
CID 783135

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 62869364) is 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CNc1nc(Cl)nc(N2CCOCC2)n1.
What is the InChIKey of 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is AFBPTIRLDGHXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12ClN5O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H,10,11,12,13).
What are the key properties of 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 229.67 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 62869364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).