5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine

C15H28N4 — CID 83185815

IUPAC5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
SMILESCCNCc1cnc(N(CC(C)C)C(C)C)nc1C
InChIInChI=1S/C15H28N4/c1-7-16-8-14-9-17-15(18-13(14)6)19(12(4)5)10-11(2)3/h9,11-12,16H,7-8,10H2,1-6H3
InChIKeyZOPNXLCBKKNECX-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.77
Rot. Bonds7

About 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine

5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine (PubChem CID 83185815) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
PubChem CID83185815
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
SMILESCCNCc1cnc(N(CC(C)C)C(C)C)nc1C
InChIInChI=1S/C15H28N4/c1-7-16-8-14-9-17-15(18-13(14)6)19(12(4)5)10-11(2)3/h9,11-12,16H,7-8,10H2,1-6H3
InChIKeyZOPNXLCBKKNECX-UHFFFAOYSA-N
XLogP2.77
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine (CID 83185815) is 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine is CCNCc1cnc(N(CC(C)C)C(C)C)nc1C.
What is the InChIKey of 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine?
The InChIKey is ZOPNXLCBKKNECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-7-16-8-14-9-17-15(18-13(14)6)19(12(4)5)10-11(2)3/h9,11-12,16H,7-8,10H2,1-6H3.
What are the key properties of 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine?
5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 83185815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).