2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide

C15H23FN2O — CID 54870454

IUPAC2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide
SMILESCC(C)CC(N)C(=O)N(C)C(C)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-10(2)9-14(17)15(19)18(4)11(3)12-7-5-6-8-13(12)16/h5-8,10-11,14H,9,17H2,1-4H3
InChIKeyCVYHMIOXODRCBK-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.72
Rot. Bonds5

About 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide

2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide (PubChem CID 54870454) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide.

Molecular Properties

Compound Name2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide
PubChem CID54870454
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide
SMILESCC(C)CC(N)C(=O)N(C)C(C)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-10(2)9-14(17)15(19)18(4)11(3)12-7-5-6-8-13(12)16/h5-8,10-11,14H,9,17H2,1-4H3
InChIKeyCVYHMIOXODRCBK-UHFFFAOYSA-N
XLogP2.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-[1-(2-chlorophenyl)ethyl]-N,4-dimethylpentanamide
CID 104903057
(2R)-2-amino-N-[1-(2-fluorophenyl)ethyl]-N-methyl-4-methylsulfanylbutanamide
CID 104907700
(2S)-2-amino-N-[1-(2-fluorophenyl)ethyl]-N,3-dimethylpentanamide
CID 61172862
3-amino-N-[1-(2-fluorophenyl)ethyl]-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119710675
(2S)-2-amino-N-[(1R)-1-(2-fluorophenyl)ethyl]-4-methylpentanamide
CID 81377311
(2S)-2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbutanamide
CID 79024859
N-[1-(2-fluorophenyl)ethyl]-N-methyl-2-(methylamino)acetamide
CID 60939648
(4S)-4-amino-N-[(1R)-1-(2-fluorophenyl)ethyl]-N-methyl-4-phenylbutanamide
CID 99804367
N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide
CID 79200476
4-(aminomethyl)-N-[1-(2-fluorophenyl)ethyl]-N-methylbenzamide
CID 60938948
N-[1-(2-fluorophenyl)ethyl]-N-methylbut-2-enamide
CID 112725705
2-amino-N-[1-(2-chlorophenyl)ethyl]-N-methylpentanamide
CID 54870533

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide?
The IUPAC name of 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide (CID 54870454) is 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide.
What is the SMILES notation for 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide?
The canonical SMILES for 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide is CC(C)CC(N)C(=O)N(C)C(C)c1ccccc1F.
What is the InChIKey of 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide?
The InChIKey is CVYHMIOXODRCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-10(2)9-14(17)15(19)18(4)11(3)12-7-5-6-8-13(12)16/h5-8,10-11,14H,9,17H2,1-4H3.
What are the key properties of 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide?
2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide has a molecular weight of 266.36 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide is sourced from PubChem (CID 54870454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).