N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine

C11H22N2O — CID 79050602

IUPACN,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine
SMILESC=CC(NC)C(C)(C)N1CCOCC1
InChIInChI=1S/C11H22N2O/c1-5-10(12-4)11(2,3)13-6-8-14-9-7-13/h5,10,12H,1,6-9H2,2-4H3
InChIKeyPPWBFDTVDPEBKY-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.87
Rot. Bonds4

About N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine

N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine (PubChem CID 79050602) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine.

Molecular Properties

Compound NameN,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine
PubChem CID79050602
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine
SMILESC=CC(NC)C(C)(C)N1CCOCC1
InChIInChI=1S/C11H22N2O/c1-5-10(12-4)11(2,3)13-6-8-14-9-7-13/h5,10,12H,1,6-9H2,2-4H3
InChIKeyPPWBFDTVDPEBKY-UHFFFAOYSA-N
XLogP0.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine?
The IUPAC name of N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine (CID 79050602) is N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine.
What is the SMILES notation for N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine?
The canonical SMILES for N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine is C=CC(NC)C(C)(C)N1CCOCC1.
What is the InChIKey of N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine?
The InChIKey is PPWBFDTVDPEBKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-10(12-4)11(2,3)13-6-8-14-9-7-13/h5,10,12H,1,6-9H2,2-4H3.
What are the key properties of N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine?
N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine has a molecular weight of 198.31 g/mol, XLogP of 0.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-4-morpholin-4-ylpent-1-en-3-amine is sourced from PubChem (CID 79050602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).