3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine

C15H23N — CID 132503899

IUPAC3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine
SMILESC=CC(CC)(CCN(C)C)c1ccccc1
InChIInChI=1S/C15H23N/c1-5-15(6-2,12-13-16(3)4)14-10-8-7-9-11-14/h5,7-11H,1,6,12-13H2,2-4H3
InChIKeyCFOVFUYCBHAFOJ-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.47
Rot. Bonds6

About 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine

3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine (PubChem CID 132503899) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine.

Molecular Properties

Compound Name3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine
PubChem CID132503899
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine
SMILESC=CC(CC)(CCN(C)C)c1ccccc1
InChIInChI=1S/C15H23N/c1-5-15(6-2,12-13-16(3)4)14-10-8-7-9-11-14/h5,7-11H,1,6,12-13H2,2-4H3
InChIKeyCFOVFUYCBHAFOJ-UHFFFAOYSA-N
XLogP3.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-ethyl-N,N-dimethyl-3-phenylpent-4-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

4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenylbutanenitrile;hydrochloride
CID 54599725
3-(chloromethyl)dodec-1-en-3-ylbenzene
CID 157318914
[3-(dimethylamino)-1,1-diphenylpropyl] formate
CID 54028396
2-amino-4-(dimethylamino)-2-phenylbutan-1-ol
CID 116695084
N,N-dimethyl-3-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pentan-1-amine
CID 132503896
5-(dimethylamino)-2,2-diphenylpentanal
CID 88611833
(1R)-1-(2-chlorophenyl)-3-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 73415977
3-phenyl-N-prop-2-enylpentan-3-amine
CID 174436500
4-(dimethylamino)-1-phenyl-1-[2-(trifluoromethyl)phenyl]butan-1-ol
CID 163905024
4-[bis(prop-2-enyl)amino]-1,1-diphenylbutan-1-ol
CID 3026470
N-ethyl-N-methyl-2-phenylpent-4-en-2-amine
CID 174778712
(1-ethyl-1-phenylprop-2-enyl)sulfanylbenzene
CID 163524886

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine?
The IUPAC name of 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine (CID 132503899) is 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine.
What is the SMILES notation for 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine?
The canonical SMILES for 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine is C=CC(CC)(CCN(C)C)c1ccccc1.
What is the InChIKey of 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine?
The InChIKey is CFOVFUYCBHAFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-5-15(6-2,12-13-16(3)4)14-10-8-7-9-11-14/h5,7-11H,1,6,12-13H2,2-4H3.
What are the key properties of 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine?
3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N,N-dimethyl-3-phenylpent-4-en-1-amine is sourced from PubChem (CID 132503899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).