1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine

C12H24N4 — CID 62687881

IUPAC1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine
SMILESCN(C)CCn1nc(CC(C)(C)C)cc1N
InChIInChI=1S/C12H24N4/c1-12(2,3)9-10-8-11(13)16(14-10)7-6-15(4)5/h8H,6-7,9,13H2,1-5H3
InChIKeyBVSCVRHQDFSLHD-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.62
Rot. Bonds4

About 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine

1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine (PubChem CID 62687881) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine
PubChem CID62687881
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine
SMILESCN(C)CCn1nc(CC(C)(C)C)cc1N
InChIInChI=1S/C12H24N4/c1-12(2,3)9-10-8-11(13)16(14-10)7-6-15(4)5/h8H,6-7,9,13H2,1-5H3
InChIKeyBVSCVRHQDFSLHD-UHFFFAOYSA-N
XLogP1.62
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.62
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]-3-(2,2-dimethylpropyl)pyrazol-5-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine (CID 62687881) is 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine is CN(C)CCn1nc(CC(C)(C)C)cc1N.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine?
The InChIKey is BVSCVRHQDFSLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-12(2,3)9-10-8-11(13)16(14-10)7-6-15(4)5/h8H,6-7,9,13H2,1-5H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine?
1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine has a molecular weight of 224.35 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-3-(2,2-dimethylpropyl)pyrazol-5-amine is sourced from PubChem (CID 62687881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).