2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide

C13H24N6O2 — CID 80775822

IUPAC2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide
SMILESCCCOc1nc(NCC)nc(NCC(=O)NC(C)C)n1
InChIInChI=1S/C13H24N6O2/c1-5-7-21-13-18-11(14-6-2)17-12(19-13)15-8-10(20)16-9(3)4/h9H,5-8H2,1-4H3,(H,16,20)(H2,14,15,17,18,19)
InChIKeyKPWGRAUQXRVXCG-UHFFFAOYSA-N
MW296.38 g/mol
LogP1.03
Rot. Bonds9

About 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide

2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide (PubChem CID 80775822) has the molecular formula C13H24N6O2 and a molecular weight of 296.38 g/mol. Its IUPAC name is 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide
PubChem CID80775822
Molecular FormulaC13H24N6O2
Molecular Weight296.38 g/mol
Exact Mass296.20
IUPAC Name2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide
SMILESCCCOc1nc(NCC)nc(NCC(=O)NC(C)C)n1
InChIInChI=1S/C13H24N6O2/c1-5-7-21-13-18-11(14-6-2)17-12(19-13)15-8-10(20)16-9(3)4/h9H,5-8H2,1-4H3,(H,16,20)(H2,14,15,17,18,19)
InChIKeyKPWGRAUQXRVXCG-UHFFFAOYSA-N
XLogP1.03
TPSA101.06 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.38
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide with MolForge

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Related Compounds

N-ethyl-4-(4-methylpentoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80861519
2-[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-N-propylacetamide
CID 80788310
5-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]pentan-2-ol
CID 106138247
2-[[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]ethyl acetate
CID 2055041
2-N,4-N-diethyl-6-octadecoxy-1,3,5-triazine-2,4-diamine
CID 146196905
2-N,4-N-diethyl-6-hexadecoxy-1,3,5-triazine-2,4-diamine
CID 3103369
4-N-ethyl-2-N-(5-methylhexan-2-yl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80819620
1-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-3-methoxypropan-2-ol
CID 80835670
2-N-(1-cyclopentylethyl)-4-N-ethyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80821468
4-N-ethyl-2-N-(1-methoxy-3-methylbutan-2-yl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80827418
4-(2,2-difluoroethoxy)-N-ethyl-6-propoxy-1,3,5-triazin-2-amine
CID 82010193
2-N-propan-2-yl-6-propoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80765182

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide (CID 80775822) is 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide is CCCOc1nc(NCC)nc(NCC(=O)NC(C)C)n1.
What is the InChIKey of 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide?
The InChIKey is KPWGRAUQXRVXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6O2/c1-5-7-21-13-18-11(14-6-2)17-12(19-13)15-8-10(20)16-9(3)4/h9H,5-8H2,1-4H3,(H,16,20)(H2,14,15,17,18,19).
What are the key properties of 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide?
2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide has a molecular weight of 296.38 g/mol, XLogP of 1.03, 9 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(ethylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 80775822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).