1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine

C8H15N3 — CID 54851004

IUPAC1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine
SMILESCCc1n[nH]c(C)c1CNC
InChIInChI=1S/C8H15N3/c1-4-8-7(5-9-3)6(2)10-11-8/h9H,4-5H2,1-3H3,(H,10,11)
InChIKeyKKIJPQNLCFZRDK-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.00
Rot. Bonds3

About 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine

1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine (PubChem CID 54851004) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine
PubChem CID54851004
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine
SMILESCCc1n[nH]c(C)c1CNC
InChIInChI=1S/C8H15N3/c1-4-8-7(5-9-3)6(2)10-11-8/h9H,4-5H2,1-3H3,(H,10,11)
InChIKeyKKIJPQNLCFZRDK-UHFFFAOYSA-N
XLogP1.00
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine (CID 54851004) is 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine is CCc1n[nH]c(C)c1CNC.
What is the InChIKey of 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine?
The InChIKey is KKIJPQNLCFZRDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-4-8-7(5-9-3)6(2)10-11-8/h9H,4-5H2,1-3H3,(H,10,11).
What are the key properties of 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine?
1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine has a molecular weight of 153.23 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-5-methyl-1H-pyrazol-4-yl)-N-methylmethanamine is sourced from PubChem (CID 54851004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).