undec-2-en-1-amine;hydrochloride

C11H24ClN — CID 173326659

IUPACundec-2-en-1-amine;hydrochloride
SMILESCCCCCCCCC=CCN.Cl
InChIInChI=1S/C11H23N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12;/h9-10H,2-8,11-12H2,1H3;1H
InChIKeyMKHPJZYPYIEHPS-UHFFFAOYSA-N
MW205.77 g/mol
LogP3.67
Rot. Bonds8

About undec-2-en-1-amine;hydrochloride

undec-2-en-1-amine;hydrochloride (PubChem CID 173326659) has the molecular formula C11H24ClN and a molecular weight of 205.77 g/mol. Its IUPAC name is undec-2-en-1-amine;hydrochloride.

Molecular Properties

Compound Nameundec-2-en-1-amine;hydrochloride
PubChem CID173326659
Molecular FormulaC11H24ClN
Molecular Weight205.77 g/mol
Exact Mass205.16
IUPAC Nameundec-2-en-1-amine;hydrochloride
SMILESCCCCCCCCC=CCN.Cl
InChIInChI=1S/C11H23N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12;/h9-10H,2-8,11-12H2,1H3;1H
InChIKeyMKHPJZYPYIEHPS-UHFFFAOYSA-N
XLogP3.67
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.77
LogP ≤ 53.67
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'}

Analyze undec-2-en-1-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-hept-2-en-1-amine
CID 10779517
(E)-hexacos-10-ene
CID 22172169
(Z)-docos-9-ene
CID 11690102
(E)-hexadec-6-ene
CID 5352260
(E)-nonacos-10-ene
CID 14367300
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020
triacont-12-ene
CID 54535715
(Z)-octadec-6-ene
CID 5352239
(24Z)-hexatriaconta-9,24-diene
CID 173127472

Frequently Asked Questions

What is the IUPAC name of undec-2-en-1-amine;hydrochloride?
The IUPAC name of undec-2-en-1-amine;hydrochloride (CID 173326659) is undec-2-en-1-amine;hydrochloride.
What is the SMILES notation for undec-2-en-1-amine;hydrochloride?
The canonical SMILES for undec-2-en-1-amine;hydrochloride is CCCCCCCCC=CCN.Cl.
What is the InChIKey of undec-2-en-1-amine;hydrochloride?
The InChIKey is MKHPJZYPYIEHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12;/h9-10H,2-8,11-12H2,1H3;1H.
What are the key properties of undec-2-en-1-amine;hydrochloride?
undec-2-en-1-amine;hydrochloride has a molecular weight of 205.77 g/mol, XLogP of 3.67, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for undec-2-en-1-amine;hydrochloride is sourced from PubChem (CID 173326659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).