3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide

C14H19FN2O — CID 61248085

IUPAC3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide
SMILESCC(NC(=O)CCNC1CC1)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c1-10(11-2-4-12(15)5-3-11)17-14(18)8-9-16-13-6-7-13/h2-5,10,13,16H,6-9H2,1H3,(H,17,18)
InChIKeyWUQJGALZEYGEIG-UHFFFAOYSA-N
MW250.32 g/mol
LogP2.14
Rot. Bonds6

About 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide

3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide (PubChem CID 61248085) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide
PubChem CID61248085
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide
SMILESCC(NC(=O)CCNC1CC1)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c1-10(11-2-4-12(15)5-3-11)17-14(18)8-9-16-13-6-7-13/h2-5,10,13,16H,6-9H2,1H3,(H,17,18)
InChIKeyWUQJGALZEYGEIG-UHFFFAOYSA-N
XLogP2.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-tert-butylphenyl)ethyl]-3-(cyclopropylamino)propanamide
CID 60866018
2-(cyclopentylamino)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60647303
3-(cyclopropylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
CID 106212808
3-(cyclopropylamino)-N-[1-(2-fluorophenyl)ethyl]propanamide
CID 54862156
N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(cyclopropylamino)propanamide
CID 60868181
3-(cyclopropylamino)-N-[(1S)-1-pyridin-3-ylethyl]propanamide
CID 81404464
3-amino-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 61247716
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-hydroxybutanamide
CID 81349027
N-[1-(3-acetamidophenyl)ethyl]-3-(cyclopropylamino)propanamide
CID 60979759
3-(cyclopropylamino)-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408603
3-(cyclopropylamino)-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
CID 81400565
6-[1-(4-fluorophenyl)ethylamino]-6-oxohexanoic acid
CID 54867660

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide (CID 61248085) is 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide is CC(NC(=O)CCNC1CC1)c1ccc(F)cc1.
What is the InChIKey of 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide?
The InChIKey is WUQJGALZEYGEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-10(11-2-4-12(15)5-3-11)17-14(18)8-9-16-13-6-7-13/h2-5,10,13,16H,6-9H2,1H3,(H,17,18).
What are the key properties of 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide?
3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide has a molecular weight of 250.32 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-[1-(4-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 61248085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).