2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine

C11H21N3 — CID 63975935

IUPAC2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine
SMILESCCCn1nccc1C(N)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-5-8-14-9(6-7-13-14)10(12)11(2,3)4/h6-7,10H,5,8,12H2,1-4H3
InChIKeyJKGULSWJXGNWHX-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.34
Rot. Bonds3

About 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine

2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine (PubChem CID 63975935) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine
PubChem CID63975935
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine
SMILESCCCn1nccc1C(N)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-5-8-14-9(6-7-13-14)10(12)11(2,3)4/h6-7,10H,5,8,12H2,1-4H3
InChIKeyJKGULSWJXGNWHX-UHFFFAOYSA-N
XLogP2.34
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine (CID 63975935) is 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine is CCCn1nccc1C(N)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The InChIKey is JKGULSWJXGNWHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-5-8-14-9(6-7-13-14)10(12)11(2,3)4/h6-7,10H,5,8,12H2,1-4H3.
What are the key properties of 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine has a molecular weight of 195.31 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 63975935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).