(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine

C15H28N2O — CID 134923533

IUPAC(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CCC)CCC)N1CCOCC1
InChIInChI=1S/C15H28N2O/c1-4-7-8-15(16(9-5-2)10-6-3)17-11-13-18-14-12-17/h4,7-8H,5-6,9-14H2,1-3H3/b7-4+,15-8-
InChIKeyGMKDWAJPOXMURG-GVEAZFNLSA-N
MW252.40 g/mol
LogP2.86
Rot. Bonds7

About (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine

(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine (PubChem CID 134923533) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine
PubChem CID134923533
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine
SMILESC/C=C/C=C(/N(CCC)CCC)N1CCOCC1
InChIInChI=1S/C15H28N2O/c1-4-7-8-15(16(9-5-2)10-6-3)17-11-13-18-14-12-17/h4,7-8H,5-6,9-14H2,1-3H3/b7-4+,15-8-
InChIKeyGMKDWAJPOXMURG-GVEAZFNLSA-N
XLogP2.86
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine (CID 134923533) is (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine is C/C=C/C=C(/N(CCC)CCC)N1CCOCC1.
What is the InChIKey of (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine?
The InChIKey is GMKDWAJPOXMURG-GVEAZFNLSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-7-8-15(16(9-5-2)10-6-3)17-11-13-18-14-12-17/h4,7-8H,5-6,9-14H2,1-3H3/b7-4+,15-8-.
What are the key properties of (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine?
(1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine has a molecular weight of 252.40 g/mol, XLogP of 2.86, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-1-morpholin-4-yl-N,N-dipropylpenta-1,3-dien-1-amine is sourced from PubChem (CID 134923533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).