N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine

C10H15N5O — CID 62348079

IUPACN-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine
SMILESCNCC(C)Oc1cc(C)nc2ncnn12
InChIInChI=1S/C10H15N5O/c1-7-4-9(16-8(2)5-11-3)15-10(14-7)12-6-13-15/h4,6,8,11H,5H2,1-3H3
InChIKeyUOICZXMFBLWMMR-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.42
Rot. Bonds4

About N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine

N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine (PubChem CID 62348079) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine.

Molecular Properties

Compound NameN-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine
PubChem CID62348079
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC NameN-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine
SMILESCNCC(C)Oc1cc(C)nc2ncnn12
InChIInChI=1S/C10H15N5O/c1-7-4-9(16-8(2)5-11-3)15-10(14-7)12-6-13-15/h4,6,8,11H,5H2,1-3H3
InChIKeyUOICZXMFBLWMMR-UHFFFAOYSA-N
XLogP0.42
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine?
The IUPAC name of N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine (CID 62348079) is N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine.
What is the SMILES notation for N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine?
The canonical SMILES for N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine is CNCC(C)Oc1cc(C)nc2ncnn12.
What is the InChIKey of N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine?
The InChIKey is UOICZXMFBLWMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-7-4-9(16-8(2)5-11-3)15-10(14-7)12-6-13-15/h4,6,8,11H,5H2,1-3H3.
What are the key properties of N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine?
N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine has a molecular weight of 221.26 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]propan-1-amine is sourced from PubChem (CID 62348079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).