2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide

C10H19N7O — CID 80786818

IUPAC2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide
SMILESCCN(CC)c1nc(N)nc(NC(C)C(N)=O)n1
InChIInChI=1S/C10H19N7O/c1-4-17(5-2)10-15-8(12)14-9(16-10)13-6(3)7(11)18/h6H,4-5H2,1-3H3,(H2,11,18)(H3,12,13,14,15,16)
InChIKeyGYTUVLITVBQGNM-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.41
Rot. Bonds6

About 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide

2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide (PubChem CID 80786818) has the molecular formula C10H19N7O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide.

Molecular Properties

Compound Name2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide
PubChem CID80786818
Molecular FormulaC10H19N7O
Molecular Weight253.31 g/mol
Exact Mass253.17
IUPAC Name2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide
SMILESCCN(CC)c1nc(N)nc(NC(C)C(N)=O)n1
InChIInChI=1S/C10H19N7O/c1-4-17(5-2)10-15-8(12)14-9(16-10)13-6(3)7(11)18/h6H,4-5H2,1-3H3,(H2,11,18)(H3,12,13,14,15,16)
InChIKeyGYTUVLITVBQGNM-UHFFFAOYSA-N
XLogP-0.41
TPSA123.05 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

5-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]pentanamide
CID 106241608
2-N,2-N-diethyl-4-N-(2-methylbutyl)-1,3,5-triazine-2,4,6-triamine
CID 80833177
N-[2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]ethyl]acetamide
CID 80788576
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-propan-2-ylamino]acetamide
CID 80805910
2-[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]propanamide
CID 80787461
2-N,2-N-diethyl-4-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80765267
2-N,2-N-diethyl-4-N-[1-(oxolan-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 80782031
4-N-[2-(dimethylamino)ethyl]-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
CID 80769996
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]ethanesulfonamide
CID 80788682
2-N,2-N-diethyl-4-N-[2-(3-methylbutoxy)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 80792543
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-ethylamino]-N-methylacetamide
CID 80808876
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]-N,N-dimethylethanesulfonamide
CID 106343509

Frequently Asked Questions

What is the IUPAC name of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide?
The IUPAC name of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide (CID 80786818) is 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide.
What is the SMILES notation for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide?
The canonical SMILES for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide is CCN(CC)c1nc(N)nc(NC(C)C(N)=O)n1.
What is the InChIKey of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide?
The InChIKey is GYTUVLITVBQGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N7O/c1-4-17(5-2)10-15-8(12)14-9(16-10)13-6(3)7(11)18/h6H,4-5H2,1-3H3,(H2,11,18)(H3,12,13,14,15,16).
What are the key properties of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide?
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide has a molecular weight of 253.31 g/mol, XLogP of -0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]amino]propanamide is sourced from PubChem (CID 80786818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).