6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine

C14H24N4 — CID 61241263

IUPAC6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
SMILESCCc1cc(NCCN2CCC(C)CC2)ncn1
InChIInChI=1S/C14H24N4/c1-3-13-10-14(17-11-16-13)15-6-9-18-7-4-12(2)5-8-18/h10-12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyNJOOMUATOUJTHP-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.18
Rot. Bonds5

About 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine

6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine (PubChem CID 61241263) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
PubChem CID61241263
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
SMILESCCc1cc(NCCN2CCC(C)CC2)ncn1
InChIInChI=1S/C14H24N4/c1-3-13-10-14(17-11-16-13)15-6-9-18-7-4-12(2)5-8-18/h10-12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyNJOOMUATOUJTHP-UHFFFAOYSA-N
XLogP2.18
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine (CID 61241263) is 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine is CCc1cc(NCCN2CCC(C)CC2)ncn1.
What is the InChIKey of 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine?
The InChIKey is NJOOMUATOUJTHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-3-13-10-14(17-11-16-13)15-6-9-18-7-4-12(2)5-8-18/h10-12H,3-9H2,1-2H3,(H,15,16,17).
What are the key properties of 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine?
6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 61241263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).