(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine

C15H30N2 — CID 144798134

IUPAC(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine
SMILESCCCCC(C)(CCC)C(/C=C\N)=N\C(C)C
InChIInChI=1S/C15H30N2/c1-6-8-11-15(5,10-7-2)14(9-12-16)17-13(3)4/h9,12-13H,6-8,10-11,16H2,1-5H3/b12-9-,17-14-
InChIKeyADTXQSUBKNESQC-ZIBMQLNRSA-N
MW238.42 g/mol
LogP4.30
Rot. Bonds8

About (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine

(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine (PubChem CID 144798134) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine.

Molecular Properties

Compound Name(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine
PubChem CID144798134
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine
SMILESCCCCC(C)(CCC)C(/C=C\N)=N\C(C)C
InChIInChI=1S/C15H30N2/c1-6-8-11-15(5,10-7-2)14(9-12-16)17-13(3)4/h9,12-13H,6-8,10-11,16H2,1-5H3/b12-9-,17-14-
InChIKeyADTXQSUBKNESQC-ZIBMQLNRSA-N
XLogP4.30
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine?
The IUPAC name of (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine (CID 144798134) is (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine.
What is the SMILES notation for (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine?
The canonical SMILES for (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine is CCCCC(C)(CCC)C(/C=C\N)=N\C(C)C.
What is the InChIKey of (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine?
The InChIKey is ADTXQSUBKNESQC-ZIBMQLNRSA-N. The full InChI is InChI=1S/C15H30N2/c1-6-8-11-15(5,10-7-2)14(9-12-16)17-13(3)4/h9,12-13H,6-8,10-11,16H2,1-5H3/b12-9-,17-14-.
What are the key properties of (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine?
(Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine has a molecular weight of 238.42 g/mol, XLogP of 4.30, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-3-propan-2-ylimino-4-propyloct-1-en-1-amine is sourced from PubChem (CID 144798134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).