[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol

C11H19N3O — CID 106757997

IUPAC[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
SMILESCC(NCC1(CO)CC1)c1ccnn1C
InChIInChI=1S/C11H19N3O/c1-9(10-3-6-13-14(10)2)12-7-11(8-15)4-5-11/h3,6,9,12,15H,4-5,7-8H2,1-2H3
InChIKeyPJBCUTKUQYEZQX-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.84
Rot. Bonds5

About [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol

[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol (PubChem CID 106757997) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
PubChem CID106757997
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
SMILESCC(NCC1(CO)CC1)c1ccnn1C
InChIInChI=1S/C11H19N3O/c1-9(10-3-6-13-14(10)2)12-7-11(8-15)4-5-11/h3,6,9,12,15H,4-5,7-8H2,1-2H3
InChIKeyPJBCUTKUQYEZQX-UHFFFAOYSA-N
XLogP0.84
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol (CID 106757997) is [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol is CC(NCC1(CO)CC1)c1ccnn1C.
What is the InChIKey of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol?
The InChIKey is PJBCUTKUQYEZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9(10-3-6-13-14(10)2)12-7-11(8-15)4-5-11/h3,6,9,12,15H,4-5,7-8H2,1-2H3.
What are the key properties of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol?
[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol has a molecular weight of 209.29 g/mol, XLogP of 0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 106757997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).