N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine

C14H20N4O2 — CID 143071300

IUPACN-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine
SMILESCOc1ccc(-n2nc(ONC(C)(C)C)cc2C)cn1
InChIInChI=1S/C14H20N4O2/c1-10-8-13(20-17-14(2,3)4)16-18(10)11-6-7-12(19-5)15-9-11/h6-9,17H,1-5H3
InChIKeyPUFGLXNQBRTOBL-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.27
Rot. Bonds4

About N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine

N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine (PubChem CID 143071300) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine
PubChem CID143071300
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine
SMILESCOc1ccc(-n2nc(ONC(C)(C)C)cc2C)cn1
InChIInChI=1S/C14H20N4O2/c1-10-8-13(20-17-14(2,3)4)16-18(10)11-6-7-12(19-5)15-9-11/h6-9,17H,1-5H3
InChIKeyPUFGLXNQBRTOBL-UHFFFAOYSA-N
XLogP2.27
TPSA61.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-(3-tert-butyl-5-methylpyrazol-1-yl)-2-methoxypyridine
CID 59588874
1-(6-methoxy-3-pyridinyl)-5,6-dimethylindazole
CID 139333949
1-(6-methoxy-3-pyridinyl)-3-propan-2-ylpyrazol-5-amine
CID 86711514
5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine
CID 157464435
6-[3-(tert-butylcarbamoyl)-1-(6-methoxy-3-pyridinyl)pyrazol-5-yl]pyridine-3-carboxylic acid
CID 23143483
2-methoxy-5-pyrrol-1-ylpyridine
CID 4763719
1-(6-methoxy-3-pyridinyl)-2,5-dimethylpyrrole-3-carbaldehyde
CID 24694826
tert-butyl N-[2-[3-(6-methoxy-3-pyridinyl)imidazol-4-yl]ethyl]carbamate
CID 104952013
2-[4-[3-(2-hydroxypropan-2-yl)-1-(6-methoxy-3-pyridinyl)pyrazol-5-yl]phenoxy]ethylcarbamic acid
CID 69333103
[4-[1-(6-methoxy-3-pyridinyl)-3-propan-2-ylpyrazol-5-yl]phenyl]methyl N-tert-butylcarbamate
CID 91346211
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62292084
4-(3,5-dimethylpyrazol-1-yl)-2-methoxypyridine;ethane
CID 144651616

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine?
The IUPAC name of N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine (CID 143071300) is N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine.
What is the SMILES notation for N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine?
The canonical SMILES for N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine is COc1ccc(-n2nc(ONC(C)(C)C)cc2C)cn1.
What is the InChIKey of N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine?
The InChIKey is PUFGLXNQBRTOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10-8-13(20-17-14(2,3)4)16-18(10)11-6-7-12(19-5)15-9-11/h6-9,17H,1-5H3.
What are the key properties of N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine?
N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine has a molecular weight of 276.34 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methoxy-3-pyridinyl)-5-methylpyrazol-3-yl]oxy-2-methylpropan-2-amine is sourced from PubChem (CID 143071300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).