4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine

C14H24N6 — CID 80798778

IUPAC4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCCC1CCCN1c1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C14H24N6/c1-2-11-7-6-10-20(11)14-17-12(15)16-13(18-14)19-8-4-3-5-9-19/h11H,2-10H2,1H3,(H2,15,16,17,18)
InChIKeyFWEFKYVVNDYBRW-UHFFFAOYSA-N
MW276.39 g/mol
LogP1.82
Rot. Bonds3

About 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine

4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 80798778) has the molecular formula C14H24N6 and a molecular weight of 276.39 g/mol. Its IUPAC name is 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID80798778
Molecular FormulaC14H24N6
Molecular Weight276.39 g/mol
Exact Mass276.21
IUPAC Name4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCCC1CCCN1c1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C14H24N6/c1-2-11-7-6-10-20(11)14-17-12(15)16-13(18-14)19-8-4-3-5-9-19/h11H,2-10H2,1H3,(H2,15,16,17,18)
InChIKeyFWEFKYVVNDYBRW-UHFFFAOYSA-N
XLogP1.82
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-4-(2-ethylpyrrolidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80774727
4-(3-ethylpiperidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80775661
4-N,4-N-diethyl-6-(2-ethylpiperidin-1-yl)-1,3,5-triazine-2,4-diamine
CID 80776049
4-(2-ethylpyrrolidin-1-yl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80798127
4-(2-propan-2-ylpyrrolidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80855973
1-[4-(2-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]azepane
CID 112925859
4-(4-methylazepan-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80834390
2-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 116796494
2-N-[(1-ethylpyrrolidin-2-yl)methyl]-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80773177
4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 55251303
[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]azepan-2-yl]methanol
CID 116640714
[2-(2-ethylazepan-1-yl)pyrimidin-4-yl]methanamine
CID 107542232

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 80798778) is 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine is CCC1CCCN1c1nc(N)nc(N2CCCCC2)n1.
What is the InChIKey of 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is FWEFKYVVNDYBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6/c1-2-11-7-6-10-20(11)14-17-12(15)16-13(18-14)19-8-4-3-5-9-19/h11H,2-10H2,1H3,(H2,15,16,17,18).
What are the key properties of 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 276.39 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpyrrolidin-1-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80798778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).