8-prop-2-enylundec-10-en-1-amine

C14H27N — CID 87161058

IUPAC8-prop-2-enylundec-10-en-1-amine
SMILESC=CCC(CC=C)CCCCCCCN
InChIInChI=1S/C14H27N/c1-3-10-14(11-4-2)12-8-6-5-7-9-13-15/h3-4,14H,1-2,5-13,15H2
InChIKeySUHYSGSOAOTIQD-UHFFFAOYSA-N
MW209.38 g/mol
LogP4.05
Rot. Bonds11

About 8-prop-2-enylundec-10-en-1-amine

8-prop-2-enylundec-10-en-1-amine (PubChem CID 87161058) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 8-prop-2-enylundec-10-en-1-amine.

Molecular Properties

Compound Name8-prop-2-enylundec-10-en-1-amine
PubChem CID87161058
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name8-prop-2-enylundec-10-en-1-amine
SMILESC=CCC(CC=C)CCCCCCCN
InChIInChI=1S/C14H27N/c1-3-10-14(11-4-2)12-8-6-5-7-9-13-15/h3-4,14H,1-2,5-13,15H2
InChIKeySUHYSGSOAOTIQD-UHFFFAOYSA-N
XLogP4.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-prop-2-enylundec-10-en-1-amine?
The IUPAC name of 8-prop-2-enylundec-10-en-1-amine (CID 87161058) is 8-prop-2-enylundec-10-en-1-amine.
What is the SMILES notation for 8-prop-2-enylundec-10-en-1-amine?
The canonical SMILES for 8-prop-2-enylundec-10-en-1-amine is C=CCC(CC=C)CCCCCCCN.
What is the InChIKey of 8-prop-2-enylundec-10-en-1-amine?
The InChIKey is SUHYSGSOAOTIQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-3-10-14(11-4-2)12-8-6-5-7-9-13-15/h3-4,14H,1-2,5-13,15H2.
What are the key properties of 8-prop-2-enylundec-10-en-1-amine?
8-prop-2-enylundec-10-en-1-amine has a molecular weight of 209.38 g/mol, XLogP of 4.05, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-prop-2-enylundec-10-en-1-amine is sourced from PubChem (CID 87161058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).