4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine

C14H25N5 — CID 114597917

IUPAC4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine
SMILESCCNc1cc(N2CC(C)CC(C)C2C)nc(N)n1
InChIInChI=1S/C14H25N5/c1-5-16-12-7-13(18-14(15)17-12)19-8-9(2)6-10(3)11(19)4/h7,9-11H,5-6,8H2,1-4H3,(H3,15,16,17,18)
InChIKeyQQWZUOVXNYKKFD-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.36
Rot. Bonds3

About 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine

4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine (PubChem CID 114597917) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine
PubChem CID114597917
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine
SMILESCCNc1cc(N2CC(C)CC(C)C2C)nc(N)n1
InChIInChI=1S/C14H25N5/c1-5-16-12-7-13(18-14(15)17-12)19-8-9(2)6-10(3)11(19)4/h7,9-11H,5-6,8H2,1-4H3,(H3,15,16,17,18)
InChIKeyQQWZUOVXNYKKFD-UHFFFAOYSA-N
XLogP2.36
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,4-dimethylpyrrolidin-1-yl)-N-ethyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106773251
6-(1,3-dihydroisoindol-2-yl)-4-N-ethylpyrimidine-2,4-diamine
CID 80822823
4-N-(3,5-dimethylcyclohexyl)-6-N-ethylpyrimidine-2,4,6-triamine
CID 80840975
4-N-ethyl-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidine-2,4-diamine
CID 80816046
1-[2-amino-6-(ethylamino)pyrimidin-4-yl]piperidine-2-carboxamide
CID 80806613
[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]azepan-2-yl]methanol
CID 116640645
2-[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]piperidin-2-yl]ethanol
CID 80767376
4-[2-amino-6-(ethylamino)pyrimidin-4-yl]-3-ethylpiperazin-2-one
CID 80833939
[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
CID 102721159
N-ethyl-8-(2,3,5-trimethylpiperidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 114597910
6-(2,5-dimethylpiperidin-1-yl)-N,2-diethylpyrimidin-4-amine
CID 80942396
2-tert-butyl-6-(2,5-dimethylpiperidin-1-yl)-N-ethylpyrimidin-4-amine
CID 80959965

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine?
The IUPAC name of 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine (CID 114597917) is 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine is CCNc1cc(N2CC(C)CC(C)C2C)nc(N)n1.
What is the InChIKey of 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine?
The InChIKey is QQWZUOVXNYKKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-5-16-12-7-13(18-14(15)17-12)19-8-9(2)6-10(3)11(19)4/h7,9-11H,5-6,8H2,1-4H3,(H3,15,16,17,18).
What are the key properties of 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine?
4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine has a molecular weight of 263.39 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine is sourced from PubChem (CID 114597917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).