(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine

C16H23N — CID 146492350

IUPAC(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine
SMILESC=C/C=C\C=C/C(=C)/C=C\C=C/CC(C)NC
InChIInChI=1S/C16H23N/c1-5-6-7-9-12-15(2)13-10-8-11-14-16(3)17-4/h5-13,16-17H,1-2,14H2,3-4H3/b7-6-,11-8-,12-9-,13-10-
InChIKeyMUIDVHPWOWYFFU-YSHOEMLNSA-N
MW229.37 g/mol
LogP3.95
Rot. Bonds8

About (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine

(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine (PubChem CID 146492350) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine.

Molecular Properties

Compound Name(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine
PubChem CID146492350
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine
SMILESC=C/C=C\C=C/C(=C)/C=C\C=C/CC(C)NC
InChIInChI=1S/C16H23N/c1-5-6-7-9-12-15(2)13-10-8-11-14-16(3)17-4/h5-13,16-17H,1-2,14H2,3-4H3/b7-6-,11-8-,12-9-,13-10-
InChIKeyMUIDVHPWOWYFFU-YSHOEMLNSA-N
XLogP3.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine?
The IUPAC name of (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine (CID 146492350) is (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine.
What is the SMILES notation for (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine?
The canonical SMILES for (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine is C=C/C=C\C=C/C(=C)/C=C\C=C/CC(C)NC.
What is the InChIKey of (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine?
The InChIKey is MUIDVHPWOWYFFU-YSHOEMLNSA-N. The full InChI is InChI=1S/C16H23N/c1-5-6-7-9-12-15(2)13-10-8-11-14-16(3)17-4/h5-13,16-17H,1-2,14H2,3-4H3/b7-6-,11-8-,12-9-,13-10-.
What are the key properties of (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine?
(4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine has a molecular weight of 229.37 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,6Z,9Z,11Z)-N-methyl-8-methylidenetetradeca-4,6,9,11,13-pentaen-2-amine is sourced from PubChem (CID 146492350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).