N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine

C11H22N2 — CID 130138166

IUPACN-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine
SMILESCCNC1CC1C1CCN(C)CC1
InChIInChI=1S/C11H22N2/c1-3-12-11-8-10(11)9-4-6-13(2)7-5-9/h9-12H,3-8H2,1-2H3
InChIKeyPRQAQJXDRQXDFR-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.33
Rot. Bonds3

About N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine

N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine (PubChem CID 130138166) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine
PubChem CID130138166
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine
SMILESCCNC1CC1C1CCN(C)CC1
InChIInChI=1S/C11H22N2/c1-3-12-11-8-10(11)9-4-6-13(2)7-5-9/h9-12H,3-8H2,1-2H3
InChIKeyPRQAQJXDRQXDFR-UHFFFAOYSA-N
XLogP1.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine?
The IUPAC name of N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine (CID 130138166) is N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine.
What is the SMILES notation for N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine?
The canonical SMILES for N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine is CCNC1CC1C1CCN(C)CC1.
What is the InChIKey of N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine?
The InChIKey is PRQAQJXDRQXDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-3-12-11-8-10(11)9-4-6-13(2)7-5-9/h9-12H,3-8H2,1-2H3.
What are the key properties of N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine?
N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-methylpiperidin-4-yl)cyclopropan-1-amine is sourced from PubChem (CID 130138166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).