[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine

C14H20N4O — CID 79150480

IUPAC[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine
SMILESCCc1cc(COc2ccc(C)nc2CN)n(C)n1
InChIInChI=1S/C14H20N4O/c1-4-11-7-12(18(3)17-11)9-19-14-6-5-10(2)16-13(14)8-15/h5-7H,4,8-9,15H2,1-3H3
InChIKeyJNINBVFBSTYCJQ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.72
Rot. Bonds5

About [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine

[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine (PubChem CID 79150480) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine
PubChem CID79150480
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine
SMILESCCc1cc(COc2ccc(C)nc2CN)n(C)n1
InChIInChI=1S/C14H20N4O/c1-4-11-7-12(18(3)17-11)9-19-14-6-5-10(2)16-13(14)8-15/h5-7H,4,8-9,15H2,1-3H3
InChIKeyJNINBVFBSTYCJQ-UHFFFAOYSA-N
XLogP1.72
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-[(2,5-dimethylpyrazol-3-yl)methoxy]-6-methyl-2-pyridinyl]methanamine
CID 79163176
[6-methyl-3-[(3-propylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine
CID 79163082
[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine
CID 79151176
(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
CID 58869463
[6-methyl-3-[2-(2-methylpyrazol-3-yl)ethoxy]-2-pyridinyl]methanamine
CID 102999840
3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-2-methylbenzoic acid
CID 82826423
1-[4-bromo-2-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]phenyl]ethanamine
CID 102946267
N-[1-[2-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-5-methylphenyl]ethylidene]hydroxylamine
CID 77125349
methyl 5-amino-2-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]benzoate
CID 106955798
(1R)-1-[4-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]phenyl]ethanamine
CID 79025613
3-[(2,5-dimethylpyrazol-3-yl)methoxy]-6-methylpyridine-2-carbaldehyde
CID 79158515
[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methanamine
CID 103175605

Frequently Asked Questions

What is the IUPAC name of [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine?
The IUPAC name of [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine (CID 79150480) is [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine?
The canonical SMILES for [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine is CCc1cc(COc2ccc(C)nc2CN)n(C)n1.
What is the InChIKey of [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine?
The InChIKey is JNINBVFBSTYCJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-11-7-12(18(3)17-11)9-19-14-6-5-10(2)16-13(14)8-15/h5-7H,4,8-9,15H2,1-3H3.
What are the key properties of [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine?
[3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine has a molecular weight of 260.34 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3-ethyl-1-methylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanamine is sourced from PubChem (CID 79150480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).