N-ethenyl-1-phenylhex-5-en-1-amine

C14H19N — CID 143899130

IUPACN-ethenyl-1-phenylhex-5-en-1-amine
SMILESC=CCCCC(NC=C)c1ccccc1
InChIInChI=1S/C14H19N/c1-3-5-7-12-14(15-4-2)13-10-8-6-9-11-13/h3-4,6,8-11,14-15H,1-2,5,7,12H2
InChIKeyXVXBXUAVUKYDDU-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.82
Rot. Bonds7

About N-ethenyl-1-phenylhex-5-en-1-amine

N-ethenyl-1-phenylhex-5-en-1-amine (PubChem CID 143899130) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-ethenyl-1-phenylhex-5-en-1-amine.

Molecular Properties

Compound NameN-ethenyl-1-phenylhex-5-en-1-amine
PubChem CID143899130
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-ethenyl-1-phenylhex-5-en-1-amine
SMILESC=CCCCC(NC=C)c1ccccc1
InChIInChI=1S/C14H19N/c1-3-5-7-12-14(15-4-2)13-10-8-6-9-11-13/h3-4,6,8-11,14-15H,1-2,5,7,12H2
InChIKeyXVXBXUAVUKYDDU-UHFFFAOYSA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.82
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 N-ethenyl-1-phenylhex-5-en-1-amine 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

1-bromohex-5-enylbenzene
CID 13296849
undec-10-en-2-ylbenzene
CID 140694797
tridec-12-en-2-ylbenzene
CID 140694820
(2R)-2-(but-3-enylamino)-2-phenylethanol
CID 14716014
2-phenyl-N-propyloct-7-en-3-amine
CID 114029106
dec-1-en-5-ylbenzene;dec-9-en-5-ylbenzene
CID 158724514
(1E)-N-hydroxy-2-phenylhept-6-enimidoyl bromide
CID 100965081
[(1S)-1-fluoropent-4-enyl]benzene
CID 69121356
2-phenyldec-9-en-1-amine
CID 107010668
N-tert-butyl-2-methyl-N-(1-phenylhex-5-enoxy)propan-2-amine
CID 101115753
4,6-dimethyl-N-(1-phenylpent-4-enyl)pyrimidin-2-amine
CID 133394906
tetradec-13-en-7-ylbenzene
CID 140694824

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-1-phenylhex-5-en-1-amine?
The IUPAC name of N-ethenyl-1-phenylhex-5-en-1-amine (CID 143899130) is N-ethenyl-1-phenylhex-5-en-1-amine.
What is the SMILES notation for N-ethenyl-1-phenylhex-5-en-1-amine?
The canonical SMILES for N-ethenyl-1-phenylhex-5-en-1-amine is C=CCCCC(NC=C)c1ccccc1.
What is the InChIKey of N-ethenyl-1-phenylhex-5-en-1-amine?
The InChIKey is XVXBXUAVUKYDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-3-5-7-12-14(15-4-2)13-10-8-6-9-11-13/h3-4,6,8-11,14-15H,1-2,5,7,12H2.
What are the key properties of N-ethenyl-1-phenylhex-5-en-1-amine?
N-ethenyl-1-phenylhex-5-en-1-amine has a molecular weight of 201.31 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-1-phenylhex-5-en-1-amine is sourced from PubChem (CID 143899130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).