5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine

C13H24N4O — CID 114216442

IUPAC5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine
SMILESCCNCc1cncnc1N(C)CCOC(C)C
InChIInChI=1S/C13H24N4O/c1-5-14-8-12-9-15-10-16-13(12)17(4)6-7-18-11(2)3/h9-11,14H,5-8H2,1-4H3
InChIKeyZTUCBKQJTCLCMS-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.45
Rot. Bonds8

About 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine

5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine (PubChem CID 114216442) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine
PubChem CID114216442
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine
SMILESCCNCc1cncnc1N(C)CCOC(C)C
InChIInChI=1S/C13H24N4O/c1-5-14-8-12-9-15-10-16-13(12)17(4)6-7-18-11(2)3/h9-11,14H,5-8H2,1-4H3
InChIKeyZTUCBKQJTCLCMS-UHFFFAOYSA-N
XLogP1.45
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyrimidin-4-amine
CID 114216039
5-bromo-3-(ethylaminomethyl)-N-(2-methoxyethyl)-N-methylpyridin-2-amine
CID 62287274
N-methyl-N-(2-propan-2-yloxyethyl)-3-(propylaminomethyl)pyridin-4-amine
CID 81247408
4-N,6-N,5-trimethyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,6-diamine
CID 81068634
5-(ethylaminomethyl)-N-methyl-N-(oxan-4-yl)pyrimidin-4-amine
CID 114216043
6-chloro-4-N-methyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,5-diamine
CID 81059374
N-methyl-5-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 114216052
5-(ethylaminomethyl)-N-methyl-N-(thiolan-3-yl)pyrimidin-4-amine
CID 114215986
3-(ethylaminomethyl)-5-fluoro-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 106532961
N-ethyl-N-propan-2-yl-5-(propylaminomethyl)pyrimidin-4-amine
CID 114215953
5-fluoro-2-[methyl(2-propan-2-yloxyethyl)amino]pyridine-3-carboxylic acid
CID 114034507
3-N-methyl-3-N-(2-propan-2-yloxyethyl)pyrazine-2,3-diamine
CID 103768529

Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine?
The IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine (CID 114216442) is 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine is CCNCc1cncnc1N(C)CCOC(C)C.
What is the InChIKey of 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine?
The InChIKey is ZTUCBKQJTCLCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-5-14-8-12-9-15-10-16-13(12)17(4)6-7-18-11(2)3/h9-11,14H,5-8H2,1-4H3.
What are the key properties of 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine?
5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine has a molecular weight of 252.36 g/mol, XLogP of 1.45, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine is sourced from PubChem (CID 114216442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).