N-ethyl-1-methylpyrazol-3-amine

C6H11N3 — CID 60809330

IUPACN-ethyl-1-methylpyrazol-3-amine
SMILESCCNc1ccn(C)n1
InChIInChI=1S/C6H11N3/c1-3-7-6-4-5-9(2)8-6/h4-5H,3H2,1-2H3,(H,7,8)
InChIKeyLHQUBLDNLWZSHV-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.85
Rot. Bonds2

About N-ethyl-1-methylpyrazol-3-amine

N-ethyl-1-methylpyrazol-3-amine (PubChem CID 60809330) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is N-ethyl-1-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-ethyl-1-methylpyrazol-3-amine
PubChem CID60809330
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC NameN-ethyl-1-methylpyrazol-3-amine
SMILESCCNc1ccn(C)n1
InChIInChI=1S/C6H11N3/c1-3-7-6-4-5-9(2)8-6/h4-5H,3H2,1-2H3,(H,7,8)
InChIKeyLHQUBLDNLWZSHV-UHFFFAOYSA-N
XLogP0.85
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methylpyrazol-3-amine?
The IUPAC name of N-ethyl-1-methylpyrazol-3-amine (CID 60809330) is N-ethyl-1-methylpyrazol-3-amine.
What is the SMILES notation for N-ethyl-1-methylpyrazol-3-amine?
The canonical SMILES for N-ethyl-1-methylpyrazol-3-amine is CCNc1ccn(C)n1.
What is the InChIKey of N-ethyl-1-methylpyrazol-3-amine?
The InChIKey is LHQUBLDNLWZSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-7-6-4-5-9(2)8-6/h4-5H,3H2,1-2H3,(H,7,8).
What are the key properties of N-ethyl-1-methylpyrazol-3-amine?
N-ethyl-1-methylpyrazol-3-amine has a molecular weight of 125.17 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methylpyrazol-3-amine is sourced from PubChem (CID 60809330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).