N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine

C14H25N5 — CID 80793772

IUPACN-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCNc1ncnc(N2CCN(C(C)C)CC2)c1C
InChIInChI=1S/C14H25N5/c1-5-15-13-12(4)14(17-10-16-13)19-8-6-18(7-9-19)11(2)3/h10-11H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyROBMXZFCGLTKEV-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.75
Rot. Bonds4

About N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine

N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine (PubChem CID 80793772) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
PubChem CID80793772
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC NameN-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCNc1ncnc(N2CCN(C(C)C)CC2)c1C
InChIInChI=1S/C14H25N5/c1-5-15-13-12(4)14(17-10-16-13)19-8-6-18(7-9-19)11(2)3/h10-11H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyROBMXZFCGLTKEV-UHFFFAOYSA-N
XLogP1.75
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(8-azaspiro[4.5]decan-8-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80831776
N-ethyl-5-methyl-6-(1,4-oxazepan-4-yl)pyrimidin-4-amine
CID 80823280
6-(4-butan-2-ylpiperazin-1-yl)-N,5-diethylpyrimidin-4-amine
CID 80803428
6-(3,3-diethylpyrrolidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80855240
6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80835406
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80854935
4-[6-(ethylamino)-5-methylpyrimidin-4-yl]piperazin-2-one
CID 80763940
1-[6-(ethylamino)-5-methylpyrimidin-4-yl]-4-methylpiperidin-3-ol
CID 102971284
N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine
CID 80788166
N,5-diethyl-6-(4-propan-2-ylpiperidin-1-yl)pyrimidin-4-amine
CID 103504582
6-(4-propan-2-ylpiperazin-1-yl)-5-propylpyrimidin-4-amine
CID 80792850
6-(2,2-dimethylpyrrolidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80828149

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine (CID 80793772) is N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine is CCNc1ncnc(N2CCN(C(C)C)CC2)c1C.
What is the InChIKey of N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine?
The InChIKey is ROBMXZFCGLTKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-5-15-13-12(4)14(17-10-16-13)19-8-6-18(7-9-19)11(2)3/h10-11H,5-9H2,1-4H3,(H,15,16,17).
What are the key properties of N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine?
N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine has a molecular weight of 263.39 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80793772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).