(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine

C14H27N3 — CID 155740812

IUPAC(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine
SMILESC=N/C=C(\C=N\CC)CCCCCCCNC
InChIInChI=1S/C14H27N3/c1-4-17-13-14(12-16-3)10-8-6-5-7-9-11-15-2/h12-13,15H,3-11H2,1-2H3/b14-12-,17-13+
InChIKeySZEMSGZXFYCVRT-XSZMWJROSA-N
MW237.39 g/mol
LogP3.22
Rot. Bonds11

About (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine

(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine (PubChem CID 155740812) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine.

Molecular Properties

Compound Name(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine
PubChem CID155740812
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine
SMILESC=N/C=C(\C=N\CC)CCCCCCCNC
InChIInChI=1S/C14H27N3/c1-4-17-13-14(12-16-3)10-8-6-5-7-9-11-15-2/h12-13,15H,3-11H2,1-2H3/b14-12-,17-13+
InChIKeySZEMSGZXFYCVRT-XSZMWJROSA-N
XLogP3.22
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine?
The IUPAC name of (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine (CID 155740812) is (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine.
What is the SMILES notation for (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine?
The canonical SMILES for (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine is C=N/C=C(\C=N\CC)CCCCCCCNC.
What is the InChIKey of (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine?
The InChIKey is SZEMSGZXFYCVRT-XSZMWJROSA-N. The full InChI is InChI=1S/C14H27N3/c1-4-17-13-14(12-16-3)10-8-6-5-7-9-11-15-2/h12-13,15H,3-11H2,1-2H3/b14-12-,17-13+.
What are the key properties of (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine?
(Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine has a molecular weight of 237.39 g/mol, XLogP of 3.22, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-8-(ethyliminomethyl)-N-methyl-9-(methylideneamino)non-8-en-1-amine is sourced from PubChem (CID 155740812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).