N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride

C10H15ClN2O — CID 22325164

IUPACN-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride
SMILESCNC1(COc2cccnc2)CC1.Cl
InChIInChI=1S/C10H14N2O.ClH/c1-11-10(4-5-10)8-13-9-3-2-6-12-7-9;/h2-3,6-7,11H,4-5,8H2,1H3;1H
InChIKeyPLBXUIATHCUOIH-UHFFFAOYSA-N
MW214.70 g/mol
LogP1.63
Rot. Bonds4

About N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride

N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride (PubChem CID 22325164) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride
PubChem CID22325164
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC NameN-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride
SMILESCNC1(COc2cccnc2)CC1.Cl
InChIInChI=1S/C10H14N2O.ClH/c1-11-10(4-5-10)8-13-9-3-2-6-12-7-9;/h2-3,6-7,11H,4-5,8H2,1H3;1H
InChIKeyPLBXUIATHCUOIH-UHFFFAOYSA-N
XLogP1.63
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride?
The IUPAC name of N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride (CID 22325164) is N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride?
The canonical SMILES for N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride is CNC1(COc2cccnc2)CC1.Cl.
What is the InChIKey of N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride?
The InChIKey is PLBXUIATHCUOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.ClH/c1-11-10(4-5-10)8-13-9-3-2-6-12-7-9;/h2-3,6-7,11H,4-5,8H2,1H3;1H.
What are the key properties of N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride?
N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride has a molecular weight of 214.70 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 22325164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).