1-[2-(dimethylamino)ethyl]pyrazol-3-amine

C7H14N4 — CID 47002600

IUPAC1-[2-(dimethylamino)ethyl]pyrazol-3-amine
SMILESCN(C)CCn1ccc(N)n1
InChIInChI=1S/C7H14N4/c1-10(2)5-6-11-4-3-7(8)9-11/h3-4H,5-6H2,1-2H3,(H2,8,9)
InChIKeyQKZGPGWTHXRTLI-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.03
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]pyrazol-3-amine

1-[2-(dimethylamino)ethyl]pyrazol-3-amine (PubChem CID 47002600) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]pyrazol-3-amine
PubChem CID47002600
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name1-[2-(dimethylamino)ethyl]pyrazol-3-amine
SMILESCN(C)CCn1ccc(N)n1
InChIInChI=1S/C7H14N4/c1-10(2)5-6-11-4-3-7(8)9-11/h3-4H,5-6H2,1-2H3,(H2,8,9)
InChIKeyQKZGPGWTHXRTLI-UHFFFAOYSA-N
XLogP0.03
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]pyrazol-3-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]pyrazol-3-amine (CID 47002600) is 1-[2-(dimethylamino)ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]pyrazol-3-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]pyrazol-3-amine is CN(C)CCn1ccc(N)n1.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]pyrazol-3-amine?
The InChIKey is QKZGPGWTHXRTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-10(2)5-6-11-4-3-7(8)9-11/h3-4H,5-6H2,1-2H3,(H2,8,9).
What are the key properties of 1-[2-(dimethylamino)ethyl]pyrazol-3-amine?
1-[2-(dimethylamino)ethyl]pyrazol-3-amine has a molecular weight of 154.22 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]pyrazol-3-amine is sourced from PubChem (CID 47002600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).