N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine

C12H24N2O — CID 62592394

IUPACN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine
SMILESCOCCN1CCC(CNC2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-15-9-8-14-6-4-11(5-7-14)10-13-12-2-3-12/h11-13H,2-10H2,1H3
InChIKeyUZDNRICYHNUQBZ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds6

About N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine (PubChem CID 62592394) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine
PubChem CID62592394
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine
SMILESCOCCN1CCC(CNC2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-15-9-8-14-6-4-11(5-7-14)10-13-12-2-3-12/h11-13H,2-10H2,1H3
InChIKeyUZDNRICYHNUQBZ-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine (CID 62592394) is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine is COCCN1CCC(CNC2CC2)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine?
The InChIKey is UZDNRICYHNUQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-15-9-8-14-6-4-11(5-7-14)10-13-12-2-3-12/h11-13H,2-10H2,1H3.
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine?
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine has a molecular weight of 212.34 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62592394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).