1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine

C14H28N2 — CID 63133014

IUPAC1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine
SMILESCCC1(CN(C)C(C)C2CC2)CCCNC1
InChIInChI=1S/C14H28N2/c1-4-14(8-5-9-15-10-14)11-16(3)12(2)13-6-7-13/h12-13,15H,4-11H2,1-3H3
InChIKeyUHORFDUXTRLZSK-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds5

About 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine

1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine (PubChem CID 63133014) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine
PubChem CID63133014
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine
SMILESCCC1(CN(C)C(C)C2CC2)CCCNC1
InChIInChI=1S/C14H28N2/c1-4-14(8-5-9-15-10-14)11-16(3)12(2)13-6-7-13/h12-13,15H,4-11H2,1-3H3
InChIKeyUHORFDUXTRLZSK-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine?
The IUPAC name of 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine (CID 63133014) is 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine is CCC1(CN(C)C(C)C2CC2)CCCNC1.
What is the InChIKey of 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine?
The InChIKey is UHORFDUXTRLZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-14(8-5-9-15-10-14)11-16(3)12(2)13-6-7-13/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine?
1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine is sourced from PubChem (CID 63133014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).