2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine

C20H30N6O — CID 133431796

IUPAC2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCC(C)c1nc(NCc2ccccc2CN2CCOCC2)nc(N(C)C)n1
InChIInChI=1S/C20H30N6O/c1-15(2)18-22-19(24-20(23-18)25(3)4)21-13-16-7-5-6-8-17(16)14-26-9-11-27-12-10-26/h5-8,15H,9-14H2,1-4H3,(H,21,22,23,24)
InChIKeyLCWCLMNECOZFRN-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.51
Rot. Bonds7

About 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine

2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine (PubChem CID 133431796) has the molecular formula C20H30N6O and a molecular weight of 370.50 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
PubChem CID133431796
Molecular FormulaC20H30N6O
Molecular Weight370.50 g/mol
Exact Mass370.25
IUPAC Name2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCC(C)c1nc(NCc2ccccc2CN2CCOCC2)nc(N(C)C)n1
InChIInChI=1S/C20H30N6O/c1-15(2)18-22-19(24-20(23-18)25(3)4)21-13-16-7-5-6-8-17(16)14-26-9-11-27-12-10-26/h5-8,15H,9-14H2,1-4H3,(H,21,22,23,24)
InChIKeyLCWCLMNECOZFRN-UHFFFAOYSA-N
XLogP2.51
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

2-N,2-N-dimethyl-4-N-(2-morpholin-4-yl-2-phenylethyl)-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133433575
4-N-[[2-(difluoromethoxy)phenyl]methyl]-2-N,2-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133433154
4-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-N,2-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133418508
2-N,2-N-dimethyl-4-N-[(3-methyl-4-pyridinyl)methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133495534
4-N-[2,2-dimethyl-3-(oxan-4-yl)propyl]-2-N,2-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133420627
1-[[6-(dimethylamino)-2-pyridinyl]methyl]-2-methyl-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]guanidine;hydroiodide
CID 109402949
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 43346970
4-N-[1-(1-benzofuran-2-yl)ethyl]-2-N,2-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133431839
4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine
CID 138579238
2-N,2-N-dimethyl-6-propan-2-yl-4-N-[(3-pyridin-2-ylphenyl)methyl]-1,3,5-triazine-2,4-diamine
CID 133421851
2-methyl-1-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]guanidine
CID 111374717
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-phenyl-1,2,4-thiadiazol-5-amine
CID 100665927

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine (CID 133431796) is 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine is CC(C)c1nc(NCc2ccccc2CN2CCOCC2)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is LCWCLMNECOZFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N6O/c1-15(2)18-22-19(24-20(23-18)25(3)4)21-13-16-7-5-6-8-17(16)14-26-9-11-27-12-10-26/h5-8,15H,9-14H2,1-4H3,(H,21,22,23,24).
What are the key properties of 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine?
2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 370.50 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 133431796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).