2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine

C14H23N3O — CID 79928842

IUPAC2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine
SMILESCc1nccc(CNC2CC(C)(C)OC2(C)C)n1
InChIInChI=1S/C14H23N3O/c1-10-15-7-6-11(17-10)9-16-12-8-13(2,3)18-14(12,4)5/h6-7,12,16H,8-9H2,1-5H3
InChIKeyBVVKDLYDJHNUNA-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.22
Rot. Bonds3

About 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine

2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine (PubChem CID 79928842) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine
PubChem CID79928842
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine
SMILESCc1nccc(CNC2CC(C)(C)OC2(C)C)n1
InChIInChI=1S/C14H23N3O/c1-10-15-7-6-11(17-10)9-16-12-8-13(2,3)18-14(12,4)5/h6-7,12,16H,8-9H2,1-5H3
InChIKeyBVVKDLYDJHNUNA-UHFFFAOYSA-N
XLogP2.22
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-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

2,2,5,5-tetramethyl-N-[(6-methyl-3-pyridinyl)methyl]oxolan-3-amine
CID 79928608
N-[(2-methylpyrimidin-4-yl)methyl]cyclohexanamine
CID 60962032
2,2,5,5-tetramethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]oxolan-3-amine
CID 79927526
2,2,5,5-tetramethyl-N-(quinolin-8-ylmethyl)oxolan-3-amine
CID 81333756
(3S)-N-[(2,5-dimethyl-1,3-thiazol-4-yl)methyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 97108473
N-(furan-2-ylmethyl)-2,2,5,5-tetramethyloxolan-3-amine
CID 79915639
(3R)-2,2,5,5-tetramethyl-N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]oxolan-3-amine
CID 129345379
2,2,5,5-tetramethyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]oxolan-3-amine
CID 84587732
trans-(1R,2R)-2-[(2-methylpyrimidin-4-yl)methylamino]cyclopentan-1-ol
CID 93444311
2,2,5,5-tetramethyl-N-(naphthalen-1-ylmethyl)oxolan-3-amine
CID 79911054
2,2,5,5-tetramethyl-N-(thiophen-2-ylmethyl)oxolan-3-amine
CID 79918908
(3R)-N-(1,3-benzoxazol-2-ylmethyl)-2,2,5,5-tetramethyloxolan-3-amine
CID 99632854

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine (CID 79928842) is 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine is Cc1nccc(CNC2CC(C)(C)OC2(C)C)n1.
What is the InChIKey of 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine?
The InChIKey is BVVKDLYDJHNUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-10-15-7-6-11(17-10)9-16-12-8-13(2,3)18-14(12,4)5/h6-7,12,16H,8-9H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine?
2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine has a molecular weight of 249.36 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-[(2-methylpyrimidin-4-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 79928842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).