[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol

C11H16N2O — CID 63042187

IUPAC[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol
SMILESCC1(c2ccccn2)CC1(CN)CO
InChIInChI=1S/C11H16N2O/c1-10(6-11(10,7-12)8-14)9-4-2-3-5-13-9/h2-5,14H,6-8,12H2,1H3
InChIKeyVBNOAXGXIOEVCZ-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.68
Rot. Bonds3

About [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol

[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol (PubChem CID 63042187) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol.

Molecular Properties

Compound Name[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol
PubChem CID63042187
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol
SMILESCC1(c2ccccn2)CC1(CN)CO
InChIInChI=1S/C11H16N2O/c1-10(6-11(10,7-12)8-14)9-4-2-3-5-13-9/h2-5,14H,6-8,12H2,1H3
InChIKeyVBNOAXGXIOEVCZ-UHFFFAOYSA-N
XLogP0.68
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol?
The IUPAC name of [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol (CID 63042187) is [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol.
What is the SMILES notation for [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol?
The canonical SMILES for [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol is CC1(c2ccccn2)CC1(CN)CO.
What is the InChIKey of [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol?
The InChIKey is VBNOAXGXIOEVCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-10(6-11(10,7-12)8-14)9-4-2-3-5-13-9/h2-5,14H,6-8,12H2,1H3.
What are the key properties of [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol?
[1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol has a molecular weight of 192.26 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)-2-methyl-2-pyridin-2-ylcyclopropyl]methanol is sourced from PubChem (CID 63042187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).