1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide

C19H20FNO2 — CID 30855901

IUPAC1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1(c2ccc(F)cc2)CC1
InChIInChI=1S/C19H20FNO2/c1-23-13-15-5-3-2-4-14(15)12-21-18(22)19(10-11-19)16-6-8-17(20)9-7-16/h2-9H,10-13H2,1H3,(H,21,22)
InChIKeyBAUVMXRQZUGXIV-UHFFFAOYSA-N
MW313.37 g/mol
LogP3.32
Rot. Bonds6

About 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide

1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide (PubChem CID 30855901) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide
PubChem CID30855901
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1(c2ccc(F)cc2)CC1
InChIInChI=1S/C19H20FNO2/c1-23-13-15-5-3-2-4-14(15)12-21-18(22)19(10-11-19)16-6-8-17(20)9-7-16/h2-9H,10-13H2,1H3,(H,21,22)
InChIKeyBAUVMXRQZUGXIV-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide (CID 30855901) is 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide is COCc1ccccc1CNC(=O)C1(c2ccc(F)cc2)CC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide?
The InChIKey is BAUVMXRQZUGXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c1-23-13-15-5-3-2-4-14(15)12-21-18(22)19(10-11-19)16-6-8-17(20)9-7-16/h2-9H,10-13H2,1H3,(H,21,22).
What are the key properties of 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide?
1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide has a molecular weight of 313.37 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 30855901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).