1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine

C9H15N3 — CID 83826856

IUPAC1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine
SMILESCNCc1cn(C)nc1C1CC1
InChIInChI=1S/C9H15N3/c1-10-5-8-6-12(2)11-9(8)7-3-4-7/h6-7,10H,3-5H2,1-2H3
InChIKeyBATYUARPYZPGER-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.02
Rot. Bonds3

About 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine

1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine (PubChem CID 83826856) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine
PubChem CID83826856
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine
SMILESCNCc1cn(C)nc1C1CC1
InChIInChI=1S/C9H15N3/c1-10-5-8-6-12(2)11-9(8)7-3-4-7/h6-7,10H,3-5H2,1-2H3
InChIKeyBATYUARPYZPGER-UHFFFAOYSA-N
XLogP1.02
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine (CID 83826856) is 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine is CNCc1cn(C)nc1C1CC1.
What is the InChIKey of 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine?
The InChIKey is BATYUARPYZPGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-10-5-8-6-12(2)11-9(8)7-3-4-7/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine?
1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-N-methylmethanamine is sourced from PubChem (CID 83826856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).