N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide

C18H19FN2O2 — CID 126772704

IUPACN-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide
SMILESO=C(CCc1cncc(F)c1)Nc1ccccc1OCC1CC1
InChIInChI=1S/C18H19FN2O2/c19-15-9-14(10-20-11-15)7-8-18(22)21-16-3-1-2-4-17(16)23-12-13-5-6-13/h1-4,9-11,13H,5-8,12H2,(H,21,22)
InChIKeyRIAPKIHMPMKOIU-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.58
Rot. Bonds7

About N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide

N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide (PubChem CID 126772704) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide
PubChem CID126772704
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide
SMILESO=C(CCc1cncc(F)c1)Nc1ccccc1OCC1CC1
InChIInChI=1S/C18H19FN2O2/c19-15-9-14(10-20-11-15)7-8-18(22)21-16-3-1-2-4-17(16)23-12-13-5-6-13/h1-4,9-11,13H,5-8,12H2,(H,21,22)
InChIKeyRIAPKIHMPMKOIU-UHFFFAOYSA-N
XLogP3.58
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclopropylmethoxy)phenyl]-4-(methylamino)butanamide;hydrochloride
CID 119799491
N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide
CID 91661447
N-[2-(cyclopropylmethoxy)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119799501
N-[2-(cyclopropylmethoxy)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119332686
N-(2-ethoxyphenyl)-3-phenylpropanamide
CID 849126
N-[2-(3-methoxypropoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 86830197
2-[2-[2-(cyclopropylmethoxy)anilino]-2-oxoethyl]-1,3-dihydroindene-2-carboxylic acid
CID 119137884
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(cyclopropylmethoxy)-4-fluorophenyl]acetamide
CID 119800663
N-[4-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide
CID 126787655
1-[2-[[4-(dimethylamino)cyclohexyl]methoxy]phenyl]-3-pyrazin-2-ylurea
CID 58842154
N-(2-ethoxyphenyl)-3-(1-phenylpyrazol-4-yl)propanamide
CID 26466144
N-(2-ethoxyphenyl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 100573859

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide?
The IUPAC name of N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide (CID 126772704) is N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide?
The canonical SMILES for N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide is O=C(CCc1cncc(F)c1)Nc1ccccc1OCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide?
The InChIKey is RIAPKIHMPMKOIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-15-9-14(10-20-11-15)7-8-18(22)21-16-3-1-2-4-17(16)23-12-13-5-6-13/h1-4,9-11,13H,5-8,12H2,(H,21,22).
What are the key properties of N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide?
N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide has a molecular weight of 314.36 g/mol, XLogP of 3.58, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)phenyl]-3-(5-fluoro-3-pyridinyl)propanamide is sourced from PubChem (CID 126772704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).