2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine

C10H19N3 — CID 84732403

IUPAC2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine
SMILESCC(C)c1ccnn1C(C)(C)CN
InChIInChI=1S/C10H19N3/c1-8(2)9-5-6-12-13(9)10(3,4)7-11/h5-6,8H,7,11H2,1-4H3
InChIKeyIEVWSTGMLZJYPW-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.70
Rot. Bonds3

About 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine

2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine (PubChem CID 84732403) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine
PubChem CID84732403
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine
SMILESCC(C)c1ccnn1C(C)(C)CN
InChIInChI=1S/C10H19N3/c1-8(2)9-5-6-12-13(9)10(3,4)7-11/h5-6,8H,7,11H2,1-4H3
InChIKeyIEVWSTGMLZJYPW-UHFFFAOYSA-N
XLogP1.70
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine?
The IUPAC name of 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine (CID 84732403) is 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine?
The canonical SMILES for 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine is CC(C)c1ccnn1C(C)(C)CN.
What is the InChIKey of 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine?
The InChIKey is IEVWSTGMLZJYPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-8(2)9-5-6-12-13(9)10(3,4)7-11/h5-6,8H,7,11H2,1-4H3.
What are the key properties of 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine?
2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(5-propan-2-ylpyrazol-1-yl)propan-1-amine is sourced from PubChem (CID 84732403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).