6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine

C15H22N4O — CID 64801745

IUPAC6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine
SMILESCCC(CC)n1ccc(COc2ccc(C)nc2N)n1
InChIInChI=1S/C15H22N4O/c1-4-13(5-2)19-9-8-12(18-19)10-20-14-7-6-11(3)17-15(14)16/h6-9,13H,4-5,10H2,1-3H3,(H2,16,17)
InChIKeyJVJGDPQBHCYLHV-UHFFFAOYSA-N
MW274.37 g/mol
LogP3.11
Rot. Bonds6

About 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine

6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine (PubChem CID 64801745) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine
PubChem CID64801745
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine
SMILESCCC(CC)n1ccc(COc2ccc(C)nc2N)n1
InChIInChI=1S/C15H22N4O/c1-4-13(5-2)19-9-8-12(18-19)10-20-14-7-6-11(3)17-15(14)16/h6-9,13H,4-5,10H2,1-3H3,(H2,16,17)
InChIKeyJVJGDPQBHCYLHV-UHFFFAOYSA-N
XLogP3.11
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

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Related Compounds

[5-chloro-2-[(1-pentan-3-ylpyrazol-3-yl)methoxy]phenyl]methanamine
CID 64800984
5-bromo-4-fluoro-2-[(1-pentan-3-ylpyrazol-3-yl)methoxy]aniline
CID 103483064
3-ethoxy-6-methylpyridin-2-amine
CID 54057030
3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]aniline
CID 64799429
1-[6-methyl-3-[(1-propan-2-ylpyrazol-3-yl)methoxy]-2-pyridinyl]propan-2-amine
CID 79164689
(1R)-1-[2-[(1-pentan-3-ylpyrazol-3-yl)methoxy]phenyl]ethanol
CID 79001134
2-[2-[(1-pentan-3-ylpyrazol-3-yl)methoxy]phenyl]ethanol
CID 107713285
3-[(5-bromo-2,3-difluorophenoxy)methyl]-1-pentan-3-ylpyrazole
CID 107098632
3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridine
CID 112558733
4-[(1-pentan-3-ylpyrazol-3-yl)methoxy]benzenecarbothioamide
CID 64801309
3-bromo-5-chloro-2-[(1-pentan-3-ylpyrazol-3-yl)methoxy]aniline
CID 64799431
3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]propan-1-amine
CID 64783227

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine?
The IUPAC name of 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine (CID 64801745) is 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine.
What is the SMILES notation for 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine?
The canonical SMILES for 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine is CCC(CC)n1ccc(COc2ccc(C)nc2N)n1.
What is the InChIKey of 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine?
The InChIKey is JVJGDPQBHCYLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-4-13(5-2)19-9-8-12(18-19)10-20-14-7-6-11(3)17-15(14)16/h6-9,13H,4-5,10H2,1-3H3,(H2,16,17).
What are the key properties of 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine?
6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine has a molecular weight of 274.37 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridin-2-amine is sourced from PubChem (CID 64801745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).