formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine

C18H19F4N3O2 — CID 156872554

IUPACformamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine
SMILESCC1COc2c1cc(C(CN)C(F)(F)F)nc2-c1ccc(F)cc1.NC=O
InChIInChI=1S/C17H16F4N2O.CH3NO/c1-9-8-24-16-12(9)6-14(13(7-22)17(19,20)21)23-15(16)10-2-4-11(18)5-3-10;2-1-3/h2-6,9,13H,7-8,22H2,1H3;1H,(H2,2,3)
InChIKeyINDZFOPLUGSTRU-UHFFFAOYSA-N
MW385.36 g/mol
LogP3.09
Rot. Bonds3

About formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine

formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine (PubChem CID 156872554) has the molecular formula C18H19F4N3O2 and a molecular weight of 385.36 g/mol. Its IUPAC name is formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine.

Molecular Properties

Compound Nameformamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine
PubChem CID156872554
Molecular FormulaC18H19F4N3O2
Molecular Weight385.36 g/mol
Exact Mass385.14
IUPAC Nameformamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine
SMILESCC1COc2c1cc(C(CN)C(F)(F)F)nc2-c1ccc(F)cc1.NC=O
InChIInChI=1S/C17H16F4N2O.CH3NO/c1-9-8-24-16-12(9)6-14(13(7-22)17(19,20)21)23-15(16)10-2-4-11(18)5-3-10;2-1-3/h2-6,9,13H,7-8,22H2,1H3;1H,(H2,2,3)
InChIKeyINDZFOPLUGSTRU-UHFFFAOYSA-N
XLogP3.09
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.36
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-8-methoxy-2-methyl-N-[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]quinoline-6-carboxamide;formamide
CID 156872800
2-[(Z)-2-aminoprop-1-enyl]-6-cyclopropyloxy-4-methylaniline;fluoromethane;N-[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]formamide
CID 156872491
4-chloro-6-[3,3,3-trifluoro-2-[3-(fluoromethyl)-7-(4-fluorophenyl)-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]-2,3-dihydro-1,3-benzothiazol-2-amine;formamide
CID 169241279
4-cyclopropyloxy-3-methoxy-N-[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]cyclohexa-1,3-diene-1-carboxamide
CID 123271054
potassium;azanide;5-[2-(2-cyclopropyl-7-fluoro-3H-benzimidazol-5-yl)ethyl]-7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridine;formamide
CID 169240809
4-[5-[3-[4-amino-3-(cyclopropyliminomethyl)-5-methoxyphenyl]-1,1,1-trifluoropropan-2-yl]-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-7-yl]-2-chlorobenzonitrile;formamide
CID 164910489
8-cyclopropyloxy-3-methyl-N-[3,3,3-trifluoro-2-[7-[4-fluoro-3-(1-fluoroethyl)phenyl]-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]cinnoline-6-carboxamide;formamide
CID 156872939
methanamine;prop-1-yne;N-[3,3,3-trifluoro-2-[3-methyl-7-(4-methylphenyl)-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]-1,8-naphthyridine-3-carboxamide
CID 156718248
N-[3,3,3-trifluoro-2-[3-(fluoromethyl)-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propyl]formamide
CID 156872756
methyl 2-amino-N-[2-[[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]-2-hydroxypropyl]amino]propan-2-yl]prop-2-enimidate
CID 163575082
(E)-2-aminoethenol;5-(2-cyclopropyloxy-4-methylphenyl)-2-(trifluoromethyl)pyridine;N-[2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]ethyl]formamide;1,1,1-trifluoroethane
CID 156718106
N-[2-[7-(3-chloro-4,5-difluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]-2-cyclopropylethyl]formamide
CID 169240887

Frequently Asked Questions

What is the IUPAC name of formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine?
The IUPAC name of formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine (CID 156872554) is formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine.
What is the SMILES notation for formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine?
The canonical SMILES for formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine is CC1COc2c1cc(C(CN)C(F)(F)F)nc2-c1ccc(F)cc1.NC=O.
What is the InChIKey of formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine?
The InChIKey is INDZFOPLUGSTRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F4N2O.CH3NO/c1-9-8-24-16-12(9)6-14(13(7-22)17(19,20)21)23-15(16)10-2-4-11(18)5-3-10;2-1-3/h2-6,9,13H,7-8,22H2,1H3;1H,(H2,2,3).
What are the key properties of formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine?
formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine has a molecular weight of 385.36 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propan-1-amine is sourced from PubChem (CID 156872554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).