N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine

C12H21N5O2 — CID 80764718

IUPACN-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NC)nc(N2CCOC(C)C2)n1
InChIInChI=1S/C12H21N5O2/c1-4-6-19-12-15-10(13-3)14-11(16-12)17-5-7-18-9(2)8-17/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyKSYCXDMBHBKZMP-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.93
Rot. Bonds5

About N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine

N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80764718) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80764718
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC NameN-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NC)nc(N2CCOC(C)C2)n1
InChIInChI=1S/C12H21N5O2/c1-4-6-19-12-15-10(13-3)14-11(16-12)17-5-7-18-9(2)8-17/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyKSYCXDMBHBKZMP-UHFFFAOYSA-N
XLogP0.93
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-4-(2-methylmorpholin-4-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80763829
4-(3-ethylpiperidin-1-yl)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80793428
4-[4-(methylamino)-6-propoxy-1,3,5-triazin-2-yl]piperazine-2,6-dione
CID 80856196
4-(3,4-dimethylpyrrolidin-1-yl)-N-ethyl-6-propoxy-1,3,5-triazin-2-amine
CID 80848798
N-methyl-4-pentoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80865018
4-(4,6-dimethoxy-1,3,5-triazin-2-yl)-2-methylmorpholine
CID 67190024
1-(4-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-3-ol
CID 102971915
4-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80828072
4-hexoxy-N-methyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80842498
4-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 82751850
1-[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol
CID 114684040
4-[3-(dimethylamino)pyrrolidin-1-yl]-N-ethyl-6-propoxy-1,3,5-triazin-2-amine
CID 80810981

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine (CID 80764718) is N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(NC)nc(N2CCOC(C)C2)n1.
What is the InChIKey of N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is KSYCXDMBHBKZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-4-6-19-12-15-10(13-3)14-11(16-12)17-5-7-18-9(2)8-17/h9H,4-8H2,1-3H3,(H,13,14,15,16).
What are the key properties of N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 267.33 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-methylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80764718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).