(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine

C12H17N5O — CID 105186704

IUPAC(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine
SMILESCCn1ncc(OC)c1C(N)c1cnc(C)cn1
InChIInChI=1S/C12H17N5O/c1-4-17-12(10(18-3)7-16-17)11(13)9-6-14-8(2)5-15-9/h5-7,11H,4,13H2,1-3H3
InChIKeyFEDVUFXIOMRQGO-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.06
Rot. Bonds4

About (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine

(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine (PubChem CID 105186704) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine.

Molecular Properties

Compound Name(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine
PubChem CID105186704
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine
SMILESCCn1ncc(OC)c1C(N)c1cnc(C)cn1
InChIInChI=1S/C12H17N5O/c1-4-17-12(10(18-3)7-16-17)11(13)9-6-14-8(2)5-15-9/h5-7,11H,4,13H2,1-3H3
InChIKeyFEDVUFXIOMRQGO-UHFFFAOYSA-N
XLogP1.06
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(4-methoxy-1-propylpyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine
CID 105187158
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-1-(5-methylpyrazin-2-yl)methanamine
CID 105186619
(1-ethyl-4-methoxypyrazol-5-yl)-(4-methylthiophen-3-yl)methanamine
CID 114658384
(1-ethyl-4-methoxypyrazol-5-yl)-(3-fluoro-5-methylphenyl)methanamine
CID 114659168
(1-ethyl-4-methoxypyrazol-5-yl)-(3-methylimidazol-4-yl)methanamine
CID 114660139
(2,6-dichlorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanamine
CID 105047710
(2,6-difluorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanamine
CID 114657653
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxypropan-1-amine
CID 114657669
1-(1-ethyl-4-methoxypyrazol-5-yl)-2,2,2-trifluoroethanamine
CID 105047700
(2,4-dimethoxyphenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanamine
CID 105047931
(1-ethyl-4-methoxypyrazol-5-yl)-isoquinolin-1-ylmethanamine
CID 114651952
(1-ethyl-4-methoxypyrazol-5-yl)-(2,3,4-trifluorophenyl)methanamine
CID 105047748

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine?
The IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine (CID 105186704) is (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine.
What is the SMILES notation for (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine?
The canonical SMILES for (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine is CCn1ncc(OC)c1C(N)c1cnc(C)cn1.
What is the InChIKey of (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine?
The InChIKey is FEDVUFXIOMRQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-4-17-12(10(18-3)7-16-17)11(13)9-6-14-8(2)5-15-9/h5-7,11H,4,13H2,1-3H3.
What are the key properties of (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine?
(1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine has a molecular weight of 247.30 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-4-methoxypyrazol-5-yl)-(5-methylpyrazin-2-yl)methanamine is sourced from PubChem (CID 105186704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).