1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine

C11H23N3 — CID 66567911

IUPAC1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine
SMILESCN(C1CC1)C1CCCN(CCN)C1
InChIInChI=1S/C11H23N3/c1-13(10-4-5-10)11-3-2-7-14(9-11)8-6-12/h10-11H,2-9,12H2,1H3
InChIKeyKOOXNBUWLRJRQB-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.50
Rot. Bonds4

About 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine

1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine (PubChem CID 66567911) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine
PubChem CID66567911
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine
SMILESCN(C1CC1)C1CCCN(CCN)C1
InChIInChI=1S/C11H23N3/c1-13(10-4-5-10)11-3-2-7-14(9-11)8-6-12/h10-11H,2-9,12H2,1H3
InChIKeyKOOXNBUWLRJRQB-UHFFFAOYSA-N
XLogP0.50
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine?
The IUPAC name of 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine (CID 66567911) is 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine.
What is the SMILES notation for 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine?
The canonical SMILES for 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine is CN(C1CC1)C1CCCN(CCN)C1.
What is the InChIKey of 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine?
The InChIKey is KOOXNBUWLRJRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-13(10-4-5-10)11-3-2-7-14(9-11)8-6-12/h10-11H,2-9,12H2,1H3.
What are the key properties of 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine?
1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine has a molecular weight of 197.33 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-N-cyclopropyl-N-methylpiperidin-3-amine is sourced from PubChem (CID 66567911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).