N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide

C19H19FN2O2 — CID 144888072

IUPACN-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide
SMILESNC(=O)CN(Cc1cc(C2CC2)ccc1F)C(=O)c1ccccc1
InChIInChI=1S/C19H19FN2O2/c20-17-9-8-15(13-6-7-13)10-16(17)11-22(12-18(21)23)19(24)14-4-2-1-3-5-14/h1-5,8-10,13H,6-7,11-12H2,(H2,21,23)
InChIKeyKLDUBULGEPZUFA-UHFFFAOYSA-N
MW326.37 g/mol
LogP2.83
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide

N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide (PubChem CID 144888072) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide
PubChem CID144888072
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC NameN-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide
SMILESNC(=O)CN(Cc1cc(C2CC2)ccc1F)C(=O)c1ccccc1
InChIInChI=1S/C19H19FN2O2/c20-17-9-8-15(13-6-7-13)10-16(17)11-22(12-18(21)23)19(24)14-4-2-1-3-5-14/h1-5,8-10,13H,6-7,11-12H2,(H2,21,23)
InChIKeyKLDUBULGEPZUFA-UHFFFAOYSA-N
XLogP2.83
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide (CID 144888072) is N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide is NC(=O)CN(Cc1cc(C2CC2)ccc1F)C(=O)c1ccccc1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide?
The InChIKey is KLDUBULGEPZUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c20-17-9-8-15(13-6-7-13)10-16(17)11-22(12-18(21)23)19(24)14-4-2-1-3-5-14/h1-5,8-10,13H,6-7,11-12H2,(H2,21,23).
What are the key properties of N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide?
N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide has a molecular weight of 326.37 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-[(5-cyclopropyl-2-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 144888072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).