N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide

C14H19FN2O2 — CID 43401121

IUPACN-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide
SMILESCOc1ccc(C(C)NCC(=O)NC2CC2)cc1F
InChIInChI=1S/C14H19FN2O2/c1-9(16-8-14(18)17-11-4-5-11)10-3-6-13(19-2)12(15)7-10/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,17,18)
InChIKeyLHXBOCPZIMOJDM-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.76
Rot. Bonds6

About N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide

N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide (PubChem CID 43401121) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide
PubChem CID43401121
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide
SMILESCOc1ccc(C(C)NCC(=O)NC2CC2)cc1F
InChIInChI=1S/C14H19FN2O2/c1-9(16-8-14(18)17-11-4-5-11)10-3-6-13(19-2)12(15)7-10/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,17,18)
InChIKeyLHXBOCPZIMOJDM-UHFFFAOYSA-N
XLogP1.76
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[1-(3,4-dimethylphenyl)ethylamino]acetamide
CID 43568283
2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]-N,N-dimethylacetamide
CID 43214750
2-chloro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]prop-2-en-1-amine
CID 115575005
1-cyclopentyl-3-[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]urea
CID 38163692
1-cyclohexyl-3-[1-(3-fluoro-4-methoxyphenyl)ethyl]urea
CID 47010316
2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]-N-(2-phenylpropyl)acetamide
CID 47011194
2-[1-(4-tert-butylphenyl)ethylamino]-N-cyclopropylacetamide
CID 43568343
2-[1-(4-bromophenyl)ethylamino]-N-cyclopropylacetamide
CID 43398074
2-[[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]ethanol
CID 29039036
4-ethyl-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 43225789
(2R)-1-[1-(3-fluoro-4-methoxyphenyl)ethylamino]propan-2-ol
CID 103906950
N-cycloheptyl-2-[[(1R)-1-(3-fluorophenyl)ethyl]amino]acetamide
CID 81352151

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide (CID 43401121) is N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide is COc1ccc(C(C)NCC(=O)NC2CC2)cc1F.
What is the InChIKey of N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide?
The InChIKey is LHXBOCPZIMOJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-9(16-8-14(18)17-11-4-5-11)10-3-6-13(19-2)12(15)7-10/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,17,18).
What are the key properties of N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide?
N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide has a molecular weight of 266.32 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide is sourced from PubChem (CID 43401121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).