(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine

C11H20N2 — CID 134406760

IUPAC(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine
SMILESC/C=C\NC1CCN(C)C/C1=C/C
InChIInChI=1S/C11H20N2/c1-4-7-12-11-6-8-13(3)9-10(11)5-2/h4-5,7,11-12H,6,8-9H2,1-3H3/b7-4-,10-5-
InChIKeyUOCDMKUXXBDVLO-YFXCQFTDSA-N
MW180.30 g/mol
LogP1.76
Rot. Bonds2

About (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine

(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine (PubChem CID 134406760) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine.

Molecular Properties

Compound Name(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine
PubChem CID134406760
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC Name(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine
SMILESC/C=C\NC1CCN(C)C/C1=C/C
InChIInChI=1S/C11H20N2/c1-4-7-12-11-6-8-13(3)9-10(11)5-2/h4-5,7,11-12H,6,8-9H2,1-3H3/b7-4-,10-5-
InChIKeyUOCDMKUXXBDVLO-YFXCQFTDSA-N
XLogP1.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine?
The IUPAC name of (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine (CID 134406760) is (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine.
What is the SMILES notation for (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine?
The canonical SMILES for (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine is C/C=C\NC1CCN(C)C/C1=C/C.
What is the InChIKey of (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine?
The InChIKey is UOCDMKUXXBDVLO-YFXCQFTDSA-N. The full InChI is InChI=1S/C11H20N2/c1-4-7-12-11-6-8-13(3)9-10(11)5-2/h4-5,7,11-12H,6,8-9H2,1-3H3/b7-4-,10-5-.
What are the key properties of (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine?
(3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine has a molecular weight of 180.30 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-ethylidene-1-methyl-N-[(Z)-prop-1-enyl]piperidin-4-amine is sourced from PubChem (CID 134406760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).