2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol

C11H17N7O — CID 80796446

IUPAC2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C11H17N7O/c1-2-4-17(6-7-19)10-14-9(12)15-11(16-10)18-5-3-13-8-18/h3,5,8,19H,2,4,6-7H2,1H3,(H2,12,14,15,16)
InChIKeyKFVZBTWAHLZHEE-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.15
Rot. Bonds6

About 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol

2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol (PubChem CID 80796446) has the molecular formula C11H17N7O and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol
PubChem CID80796446
Molecular FormulaC11H17N7O
Molecular Weight263.30 g/mol
Exact Mass263.15
IUPAC Name2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C11H17N7O/c1-2-4-17(6-7-19)10-14-9(12)15-11(16-10)18-5-3-13-8-18/h3,5,8,19H,2,4,6-7H2,1H3,(H2,12,14,15,16)
InChIKeyKFVZBTWAHLZHEE-UHFFFAOYSA-N
XLogP-0.15
TPSA105.98 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol with MolForge

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Related Compounds

6-imidazol-1-yl-4-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80764046
4-N-ethyl-6-imidazol-1-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80773693
2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propan-2-ylamino]ethanol
CID 80810035
2-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)-ethylamino]ethanol
CID 62862670
4-hydrazinyl-6-imidazol-1-yl-N,N-dipropyl-1,3,5-triazin-2-amine
CID 80931860
4-N-ethyl-4-N-(2-ethylbutyl)-6-imidazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80779658
6-imidazol-1-yl-4-N-methyl-4-N-(2-methylsulfonylethyl)-1,3,5-triazine-2,4-diamine
CID 80849549
6-imidazol-1-yl-4-N-(2-methylpropyl)-4-N-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 80820982
3-[[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-methylamino]methyl]cyclobutan-1-ol
CID 80856191
N-(cyclopropylmethyl)-4-hydrazinyl-6-imidazol-1-yl-N-propyl-1,3,5-triazin-2-amine
CID 80900414
2-[[4-amino-6-[2-hydroxyethyl(propyl)amino]-1,3,5-triazin-2-yl]amino]ethanol
CID 68587317
3-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]propan-1-ol
CID 80772756

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol?
The IUPAC name of 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol (CID 80796446) is 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol.
What is the SMILES notation for 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol?
The canonical SMILES for 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol is CCCN(CCO)c1nc(N)nc(-n2ccnc2)n1.
What is the InChIKey of 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol?
The InChIKey is KFVZBTWAHLZHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7O/c1-2-4-17(6-7-19)10-14-9(12)15-11(16-10)18-5-3-13-8-18/h3,5,8,19H,2,4,6-7H2,1H3,(H2,12,14,15,16).
What are the key properties of 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol?
2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol has a molecular weight of 263.30 g/mol, XLogP of -0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-propylamino]ethanol is sourced from PubChem (CID 80796446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).