2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide

C14H19FN2O — CID 60868325

IUPAC2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide
SMILESO=C(CNCC1CC1)NCCc1cccc(F)c1
InChIInChI=1S/C14H19FN2O/c15-13-3-1-2-11(8-13)6-7-17-14(18)10-16-9-12-4-5-12/h1-3,8,12,16H,4-7,9-10H2,(H,17,18)
InChIKeyJJLSYAWVFPWUQB-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.48
Rot. Bonds7

About 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide

2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide (PubChem CID 60868325) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide
PubChem CID60868325
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide
SMILESO=C(CNCC1CC1)NCCc1cccc(F)c1
InChIInChI=1S/C14H19FN2O/c15-13-3-1-2-11(8-13)6-7-17-14(18)10-16-9-12-4-5-12/h1-3,8,12,16H,4-7,9-10H2,(H,17,18)
InChIKeyJJLSYAWVFPWUQB-UHFFFAOYSA-N
XLogP1.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-fluorophenyl)ethyl]-2-(methylamino)acetamide
CID 43566280
N-[2-[2-(3-fluorophenyl)ethylamino]-2-oxoethyl]-2-phenylacetamide
CID 41365353
N-ethyl-2-[2-(3-fluorophenyl)ethylamino]acetamide
CID 43401960
N-[2-(4-chlorophenyl)ethyl]-2-(cyclopropylmethylamino)acetamide
CID 61260038
2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
2-(benzylcarbamoylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide
CID 34450279
2-(cyclopropylmethylamino)-1-[4-[(3-fluorophenyl)methyl]piperidin-1-yl]ethanone;hydrochloride
CID 119736883
2-(3-fluorophenyl)ethylcarbamothioic S-acid
CID 115170336
N-[2-(3-fluorophenyl)ethyl]-2-isocyanoacetamide
CID 108814904
2-(cyclopropylmethylamino)-N-(2-naphthalen-1-ylethyl)acetamide
CID 119722516
N-[2-[2-(3-fluorophenyl)ethylamino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 26463062
2-(cyclopropylmethylamino)-1-(3-fluorophenyl)ethanone
CID 116557703

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide (CID 60868325) is 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide is O=C(CNCC1CC1)NCCc1cccc(F)c1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide?
The InChIKey is JJLSYAWVFPWUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c15-13-3-1-2-11(8-13)6-7-17-14(18)10-16-9-12-4-5-12/h1-3,8,12,16H,4-7,9-10H2,(H,17,18).
What are the key properties of 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide?
2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide has a molecular weight of 250.32 g/mol, XLogP of 1.48, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[2-(3-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 60868325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).