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

C15H30N2O — CID 63129739

IUPACN-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine
SMILESCCCC1(CN(CCOC)C2CC2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17(11-12-18-2)14-4-5-14/h14,16H,3-13H2,1-2H3
InChIKeyHLBLAKIEQOTYET-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds8

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

N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine (PubChem CID 63129739) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine
PubChem CID63129739
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine
SMILESCCCC1(CN(CCOC)C2CC2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17(11-12-18-2)14-4-5-14/h14,16H,3-13H2,1-2H3
InChIKeyHLBLAKIEQOTYET-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine?
The IUPAC name of N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine (CID 63129739) is N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine?
The canonical SMILES for N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine is CCCC1(CN(CCOC)C2CC2)CCNCC1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine?
The InChIKey is HLBLAKIEQOTYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17(11-12-18-2)14-4-5-14/h14,16H,3-13H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine?
N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(4-propylpiperidin-4-yl)methyl]cyclopropanamine is sourced from PubChem (CID 63129739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).