(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine

C12H16FN — CID 143197162

IUPAC(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine
SMILESC/C=C\N(CC)Cc1ccc(F)cc1
InChIInChI=1S/C12H16FN/c1-3-9-14(4-2)10-11-5-7-12(13)8-6-11/h3,5-9H,4,10H2,1-2H3/b9-3-
InChIKeyFHVADPYCJXTEFH-OQFOIZHKSA-N
MW193.26 g/mol
LogP3.18
Rot. Bonds4

About (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine

(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine (PubChem CID 143197162) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine
PubChem CID143197162
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine
SMILESC/C=C\N(CC)Cc1ccc(F)cc1
InChIInChI=1S/C12H16FN/c1-3-9-14(4-2)10-11-5-7-12(13)8-6-11/h3,5-9H,4,10H2,1-2H3/b9-3-
InChIKeyFHVADPYCJXTEFH-OQFOIZHKSA-N
XLogP3.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.26
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(4-fluorophenyl)methyl]-N-pentylformamide
CID 177471699
ethane;1-(4-fluorophenyl)-N,N-dimethylmethanamine
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1-[(E)-but-2-enyl]-4-fluorobenzene
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2-chloro-N-ethyl-N-[(4-fluorophenyl)methyl]ethanamine
CID 63387186
N-butyl-N-[(4-fluorophenyl)methyl]butan-1-amine
CID 6422133
N'-[(4-fluorophenyl)methyl]-N'-methylmethanediamine
CID 115225832
N-(bromomethyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 115261999
N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine
CID 174248167
N-[(4-fluorophenyl)methyl]-N-methoxybut-2-enamide
CID 142970675
N-ethyl-N-[(4-fluorophenyl)methyl]-2-methylpropanamide
CID 91015016
2-chloro-N-ethyl-N-[(4-fluorophenyl)methyl]acetamide
CID 66567846

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine?
The IUPAC name of (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine (CID 143197162) is (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine is C/C=C\N(CC)Cc1ccc(F)cc1.
What is the InChIKey of (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine?
The InChIKey is FHVADPYCJXTEFH-OQFOIZHKSA-N. The full InChI is InChI=1S/C12H16FN/c1-3-9-14(4-2)10-11-5-7-12(13)8-6-11/h3,5-9H,4,10H2,1-2H3/b9-3-.
What are the key properties of (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine?
(Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine has a molecular weight of 193.26 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-N-[(4-fluorophenyl)methyl]prop-1-en-1-amine is sourced from PubChem (CID 143197162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).