N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine

C7H14N4 — CID 129143283

IUPACN-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine
SMILESCNCc1cnn(CNC)c1
InChIInChI=1S/C7H14N4/c1-8-3-7-4-10-11(5-7)6-9-2/h4-5,8-9H,3,6H2,1-2H3
InChIKeyBUDBPUWNVWFANJ-UHFFFAOYSA-N
MW154.22 g/mol
LogP-0.22
Rot. Bonds4

About N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine

N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine (PubChem CID 129143283) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine
PubChem CID129143283
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC NameN-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine
SMILESCNCc1cnn(CNC)c1
InChIInChI=1S/C7H14N4/c1-8-3-7-4-10-11(5-7)6-9-2/h4-5,8-9H,3,6H2,1-2H3
InChIKeyBUDBPUWNVWFANJ-UHFFFAOYSA-N
XLogP-0.22
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine (CID 129143283) is N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine is CNCc1cnn(CNC)c1.
What is the InChIKey of N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine?
The InChIKey is BUDBPUWNVWFANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-8-3-7-4-10-11(5-7)6-9-2/h4-5,8-9H,3,6H2,1-2H3.
What are the key properties of N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine?
N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine has a molecular weight of 154.22 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(methylaminomethyl)pyrazol-4-yl]methanamine is sourced from PubChem (CID 129143283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).