N-ethenylnonan-4-amine

C11H23N — CID 154960138

IUPACN-ethenylnonan-4-amine
SMILESC=CNC(CCC)CCCCC
InChIInChI=1S/C11H23N/c1-4-7-8-10-11(9-5-2)12-6-3/h6,11-12H,3-5,7-10H2,1-2H3
InChIKeyYCFLVASXPSOXSH-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.47
Rot. Bonds8

About N-ethenylnonan-4-amine

N-ethenylnonan-4-amine (PubChem CID 154960138) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-ethenylnonan-4-amine.

Molecular Properties

Compound NameN-ethenylnonan-4-amine
PubChem CID154960138
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-ethenylnonan-4-amine
SMILESC=CNC(CCC)CCCCC
InChIInChI=1S/C11H23N/c1-4-7-8-10-11(9-5-2)12-6-3/h6,11-12H,3-5,7-10H2,1-2H3
InChIKeyYCFLVASXPSOXSH-UHFFFAOYSA-N
XLogP3.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-nonan-4-ylformamide
CID 144801924
N-octan-4-ylformamide
CID 22178839
N-methylundecan-4-amine
CID 60996531
N-prop-2-enylundecan-6-amine
CID 43755395
N-ethylhexadecan-4-amine
CID 63413885
N-ethenylhept-1-en-3-amine
CID 142241347
tridec-1-en-4-ylhydrazine
CID 105269672
N-methylpentadec-1-en-8-amine
CID 107011425
N-methylnon-1-en-3-amine
CID 91313419
N-ethyltridec-1-en-5-amine
CID 104987742
N-pentadecan-8-ylethenesulfinamide
CID 134309049
2-N-prop-2-enylheptane-1,2-diamine
CID 65385138

Frequently Asked Questions

What is the IUPAC name of N-ethenylnonan-4-amine?
The IUPAC name of N-ethenylnonan-4-amine (CID 154960138) is N-ethenylnonan-4-amine.
What is the SMILES notation for N-ethenylnonan-4-amine?
The canonical SMILES for N-ethenylnonan-4-amine is C=CNC(CCC)CCCCC.
What is the InChIKey of N-ethenylnonan-4-amine?
The InChIKey is YCFLVASXPSOXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-7-8-10-11(9-5-2)12-6-3/h6,11-12H,3-5,7-10H2,1-2H3.
What are the key properties of N-ethenylnonan-4-amine?
N-ethenylnonan-4-amine has a molecular weight of 169.31 g/mol, XLogP of 3.47, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylnonan-4-amine is sourced from PubChem (CID 154960138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).