(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine

C15H21N — CID 137380998

IUPAC(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine
SMILESC=C/C(=C\C)CCNCCc1ccccc1
InChIInChI=1S/C15H21N/c1-3-14(4-2)10-12-16-13-11-15-8-6-5-7-9-15/h3-9,16H,1,10-13H2,2H3/b14-4+
InChIKeyUCFHKXARXBMWNJ-LNKIKWGQSA-N
MW215.34 g/mol
LogP3.34
Rot. Bonds7

About (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine

(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine (PubChem CID 137380998) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine
PubChem CID137380998
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine
SMILESC=C/C(=C\C)CCNCCc1ccccc1
InChIInChI=1S/C15H21N/c1-3-14(4-2)10-12-16-13-11-15-8-6-5-7-9-15/h3-9,16H,1,10-13H2,2H3/b14-4+
InChIKeyUCFHKXARXBMWNJ-LNKIKWGQSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3Z,5Z)-3-ethenyl-N-(2-phenylethyl)hepta-3,5-dien-1-amine;N-hydroxy-5-methylfuran-2-carboxamide
CID 143040079
4-[2-[[(3Z)-3-ethenylhexa-3,5-dienyl]amino]ethyl]phenol
CID 145162117
ethane;1-N'-[(3Z)-3-ethenylhexa-3,5-dienyl]-1-N-(2-phenylethyl)ethene-1,1-diamine
CID 142018019
3-phenyl-N-(2-phenylethyl)propan-1-amine;hydrochloride
CID 54603294
N-butyl-N'-(2-phenylethyl)ethane-1,2-diamine
CID 54806957
N-(2-phenylethyl)prop-2-en-1-amine;hydrate
CID 174367683
(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol
CID 94271411
(E)-2-phenyl-N-(2-phenylethyl)but-2-en-1-amine
CID 90041868
3-(2-phenylethylamino)-N,N-dipropylpropanamide
CID 109024274
N-(2-phenylethyl)undecan-1-amine
CID 141108004
[2-(2-phenylethylamino)-1-prop-2-enoyloxyethyl] prop-2-enoate
CID 175049317
N,N'-bis(2-phenylethyl)octane-1,8-diamine;dihydrobromide
CID 3029610

Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine?
The IUPAC name of (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine (CID 137380998) is (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine.
What is the SMILES notation for (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine?
The canonical SMILES for (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine is C=C/C(=C\C)CCNCCc1ccccc1.
What is the InChIKey of (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine?
The InChIKey is UCFHKXARXBMWNJ-LNKIKWGQSA-N. The full InChI is InChI=1S/C15H21N/c1-3-14(4-2)10-12-16-13-11-15-8-6-5-7-9-15/h3-9,16H,1,10-13H2,2H3/b14-4+.
What are the key properties of (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine?
(Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine has a molecular weight of 215.34 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethenyl-N-(2-phenylethyl)pent-3-en-1-amine is sourced from PubChem (CID 137380998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).