1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine

C11H19N3 — CID 105447514

IUPAC1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine
SMILESCNCc1cc(C2CC2)n(C(C)C)n1
InChIInChI=1S/C11H19N3/c1-8(2)14-11(9-4-5-9)6-10(13-14)7-12-3/h6,8-9,12H,4-5,7H2,1-3H3
InChIKeyUXDOPFCKETYONN-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.06
Rot. Bonds4

About 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine

1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine (PubChem CID 105447514) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine
PubChem CID105447514
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine
SMILESCNCc1cc(C2CC2)n(C(C)C)n1
InChIInChI=1S/C11H19N3/c1-8(2)14-11(9-4-5-9)6-10(13-14)7-12-3/h6,8-9,12H,4-5,7H2,1-3H3
InChIKeyUXDOPFCKETYONN-UHFFFAOYSA-N
XLogP2.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine (CID 105447514) is 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine is CNCc1cc(C2CC2)n(C(C)C)n1.
What is the InChIKey of 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine?
The InChIKey is UXDOPFCKETYONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8(2)14-11(9-4-5-9)6-10(13-14)7-12-3/h6,8-9,12H,4-5,7H2,1-3H3.
What are the key properties of 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine?
1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-1-propan-2-ylpyrazol-3-yl)-N-methylmethanamine is sourced from PubChem (CID 105447514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).