(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine

C13H26N2O — CID 139394988

IUPAC(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine
SMILESCCN/C(=C(/C)CC)C(C)N1CCOCC1
InChIInChI=1S/C13H26N2O/c1-5-11(3)13(14-6-2)12(4)15-7-9-16-10-8-15/h12,14H,5-10H2,1-4H3/b13-11-
InChIKeyQMPSCDRURCBIKZ-QBFSEMIESA-N
MW226.36 g/mol
LogP2.00
Rot. Bonds5

About (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine

(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine (PubChem CID 139394988) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine
PubChem CID139394988
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine
SMILESCCN/C(=C(/C)CC)C(C)N1CCOCC1
InChIInChI=1S/C13H26N2O/c1-5-11(3)13(14-6-2)12(4)15-7-9-16-10-8-15/h12,14H,5-10H2,1-4H3/b13-11-
InChIKeyQMPSCDRURCBIKZ-QBFSEMIESA-N
XLogP2.00
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine?
The IUPAC name of (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine (CID 139394988) is (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine.
What is the SMILES notation for (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine?
The canonical SMILES for (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine is CCN/C(=C(/C)CC)C(C)N1CCOCC1.
What is the InChIKey of (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine?
The InChIKey is QMPSCDRURCBIKZ-QBFSEMIESA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-11(3)13(14-6-2)12(4)15-7-9-16-10-8-15/h12,14H,5-10H2,1-4H3/b13-11-.
What are the key properties of (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine?
(Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine has a molecular weight of 226.36 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-4-methyl-2-morpholin-4-ylhex-3-en-3-amine is sourced from PubChem (CID 139394988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).