2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine

C8H16N4 — CID 2758501

IUPAC2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine
SMILESCc1cc(N)n(CCN(C)C)n1
InChIInChI=1S/C8H16N4/c1-7-6-8(9)12(10-7)5-4-11(2)3/h6H,4-5,9H2,1-3H3
InChIKeyRSFHAOJRAMLILZ-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.34
Rot. Bonds3

About 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine

2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine (PubChem CID 2758501) has the molecular formula C8H16N4 and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine
PubChem CID2758501
Molecular FormulaC8H16N4
Molecular Weight168.24 g/mol
Exact Mass168.14
IUPAC Name2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine
SMILESCc1cc(N)n(CCN(C)C)n1
InChIInChI=1S/C8H16N4/c1-7-6-8(9)12(10-7)5-4-11(2)3/h6H,4-5,9H2,1-3H3
InChIKeyRSFHAOJRAMLILZ-UHFFFAOYSA-N
XLogP0.34
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine?
The IUPAC name of 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine (CID 2758501) is 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine?
The canonical SMILES for 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine is Cc1cc(N)n(CCN(C)C)n1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine?
The InChIKey is RSFHAOJRAMLILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4/c1-7-6-8(9)12(10-7)5-4-11(2)3/h6H,4-5,9H2,1-3H3.
What are the key properties of 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine?
2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine has a molecular weight of 168.24 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl]-5-methylpyrazol-3-amine is sourced from PubChem (CID 2758501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).