2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine

C15H21N5O3 — CID 128973864

IUPAC2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine
SMILESCOCc1nc(C)cc(NC[C@H]2CC[C@@H](c3nc(C)no3)O2)n1
InChIInChI=1S/C15H21N5O3/c1-9-6-13(19-14(17-9)8-21-3)16-7-11-4-5-12(22-11)15-18-10(2)20-23-15/h6,11-12H,4-5,7-8H2,1-3H3,(H,16,17,19)/t11-,12+/m1/s1
InChIKeyGCZANFQFDPLRRH-NEPJUHHUSA-N
MW319.37 g/mol
LogP1.96
Rot. Bonds6

About 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine

2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine (PubChem CID 128973864) has the molecular formula C15H21N5O3 and a molecular weight of 319.37 g/mol. Its IUPAC name is 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine
PubChem CID128973864
Molecular FormulaC15H21N5O3
Molecular Weight319.37 g/mol
Exact Mass319.16
IUPAC Name2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine
SMILESCOCc1nc(C)cc(NC[C@H]2CC[C@@H](c3nc(C)no3)O2)n1
InChIInChI=1S/C15H21N5O3/c1-9-6-13(19-14(17-9)8-21-3)16-7-11-4-5-12(22-11)15-18-10(2)20-23-15/h6,11-12H,4-5,7-8H2,1-3H3,(H,16,17,19)/t11-,12+/m1/s1
InChIKeyGCZANFQFDPLRRH-NEPJUHHUSA-N
XLogP1.96
TPSA95.19 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine 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

6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-2-propan-2-ylpyrimidin-4-amine
CID 128973858
5-chloro-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-2-amine
CID 129004564
6-methyl-2-[[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methylamino]methyl]pyridin-3-ol
CID 128994012
(2R)-1-methoxy-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-3-phenylpropan-2-amine
CID 129476009
N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 129004563
8-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]quinazolin-4-amine
CID 128968332
N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 122156200
N-(1,4-diazabicyclo[2.2.2]octan-2-ylmethyl)-2-(methoxymethyl)-6-methylpyrimidin-4-amine
CID 133399496
(3S)-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thiolan-3-amine
CID 129330675
2-(methoxymethyl)-6-methyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]pyrimidin-4-amine
CID 133486689
N-[(3-tert-butyl-1-methylpyrazol-4-yl)methyl]-1-[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methanamine
CID 128970291
2-(methoxymethyl)-6-methyl-N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]pyrimidin-4-amine
CID 133417448

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine?
The IUPAC name of 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine (CID 128973864) is 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine.
What is the SMILES notation for 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine?
The canonical SMILES for 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine is COCc1nc(C)cc(NC[C@H]2CC[C@@H](c3nc(C)no3)O2)n1.
What is the InChIKey of 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine?
The InChIKey is GCZANFQFDPLRRH-NEPJUHHUSA-N. The full InChI is InChI=1S/C15H21N5O3/c1-9-6-13(19-14(17-9)8-21-3)16-7-11-4-5-12(22-11)15-18-10(2)20-23-15/h6,11-12H,4-5,7-8H2,1-3H3,(H,16,17,19)/t11-,12+/m1/s1.
What are the key properties of 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine?
2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine has a molecular weight of 319.37 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine is sourced from PubChem (CID 128973864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).