N-methyl-1H-pyrazol-5-amine

C4H7N3 — CID 22265630

IUPACN-methyl-1H-pyrazol-5-amine
SMILESCNc1ccn[nH]1
InChIInChI=1S/C4H7N3/c1-5-4-2-3-6-7-4/h2-3H,1H3,(H2,5,6,7)
InChIKeyUFYFLBNWAMCOML-UHFFFAOYSA-N
MW97.12 g/mol
LogP0.45
Rot. Bonds1

About N-methyl-1H-pyrazol-5-amine

N-methyl-1H-pyrazol-5-amine (PubChem CID 22265630) has the molecular formula C4H7N3 and a molecular weight of 97.12 g/mol. Its IUPAC name is N-methyl-1H-pyrazol-5-amine.

Molecular Properties

Compound NameN-methyl-1H-pyrazol-5-amine
PubChem CID22265630
Molecular FormulaC4H7N3
Molecular Weight97.12 g/mol
Exact Mass97.06
IUPAC NameN-methyl-1H-pyrazol-5-amine
SMILESCNc1ccn[nH]1
InChIInChI=1S/C4H7N3/c1-5-4-2-3-6-7-4/h2-3H,1H3,(H2,5,6,7)
InChIKeyUFYFLBNWAMCOML-UHFFFAOYSA-N
XLogP0.45
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1H-pyrazol-5-amine?
The IUPAC name of N-methyl-1H-pyrazol-5-amine (CID 22265630) is N-methyl-1H-pyrazol-5-amine.
What is the SMILES notation for N-methyl-1H-pyrazol-5-amine?
The canonical SMILES for N-methyl-1H-pyrazol-5-amine is CNc1ccn[nH]1.
What is the InChIKey of N-methyl-1H-pyrazol-5-amine?
The InChIKey is UFYFLBNWAMCOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3/c1-5-4-2-3-6-7-4/h2-3H,1H3,(H2,5,6,7).
What are the key properties of N-methyl-1H-pyrazol-5-amine?
N-methyl-1H-pyrazol-5-amine has a molecular weight of 97.12 g/mol, XLogP of 0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1H-pyrazol-5-amine is sourced from PubChem (CID 22265630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).