1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine

C15H30N2O — CID 114421390

IUPAC1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine
SMILESCOCCN(CC1CC(C)CCN1)C(C)C1CC1
InChIInChI=1S/C15H30N2O/c1-12-6-7-16-15(10-12)11-17(8-9-18-3)13(2)14-4-5-14/h12-16H,4-11H2,1-3H3
InChIKeyRSQZXAPSNQNPDG-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds7

About 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine

1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine (PubChem CID 114421390) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine
PubChem CID114421390
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine
SMILESCOCCN(CC1CC(C)CCN1)C(C)C1CC1
InChIInChI=1S/C15H30N2O/c1-12-6-7-16-15(10-12)11-17(8-9-18-3)13(2)14-4-5-14/h12-16H,4-11H2,1-3H3
InChIKeyRSQZXAPSNQNPDG-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine (CID 114421390) is 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine is COCCN(CC1CC(C)CCN1)C(C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine?
The InChIKey is RSQZXAPSNQNPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12-6-7-16-15(10-12)11-17(8-9-18-3)13(2)14-4-5-14/h12-16H,4-11H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine?
1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine is sourced from PubChem (CID 114421390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).