N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide

C15H26N6O2 — CID 172725221

IUPACN-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide
SMILESCCN(CC)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1
InChIInChI=1S/C15H26N6O2/c1-7-19(8-2)13-16-14(20(9-3)11(5)22)18-15(17-13)21(10-4)12(6)23/h7-10H2,1-6H3
InChIKeyHBAXMQKQKXZBGB-UHFFFAOYSA-N
MW322.41 g/mol
LogP1.46
Rot. Bonds7

About N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide

N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide (PubChem CID 172725221) has the molecular formula C15H26N6O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide.

Molecular Properties

Compound NameN-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide
PubChem CID172725221
Molecular FormulaC15H26N6O2
Molecular Weight322.41 g/mol
Exact Mass322.21
IUPAC NameN-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide
SMILESCCN(CC)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1
InChIInChI=1S/C15H26N6O2/c1-7-19(8-2)13-16-14(20(9-3)11(5)22)18-15(17-13)21(10-4)12(6)23/h7-10H2,1-6H3
InChIKeyHBAXMQKQKXZBGB-UHFFFAOYSA-N
XLogP1.46
TPSA82.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide?
The IUPAC name of N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide (CID 172725221) is N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide.
What is the SMILES notation for N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide?
The canonical SMILES for N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide is CCN(CC)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1.
What is the InChIKey of N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide?
The InChIKey is HBAXMQKQKXZBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6O2/c1-7-19(8-2)13-16-14(20(9-3)11(5)22)18-15(17-13)21(10-4)12(6)23/h7-10H2,1-6H3.
What are the key properties of N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide?
N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide has a molecular weight of 322.41 g/mol, XLogP of 1.46, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[acetyl(ethyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl]-N-ethylacetamide is sourced from PubChem (CID 172725221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).