N-benzyl-N-cyclopropyl-2,3-difluorobenzamide

C17H15F2NO — CID 62661017

IUPACN-benzyl-N-cyclopropyl-2,3-difluorobenzamide
SMILESO=C(c1cccc(F)c1F)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H15F2NO/c18-15-8-4-7-14(16(15)19)17(21)20(13-9-10-13)11-12-5-2-1-3-6-12/h1-8,13H,9-11H2
InChIKeyKZHQRGFSXDQVGW-UHFFFAOYSA-N
MW287.31 g/mol
LogP3.77
Rot. Bonds4

About N-benzyl-N-cyclopropyl-2,3-difluorobenzamide

N-benzyl-N-cyclopropyl-2,3-difluorobenzamide (PubChem CID 62661017) has the molecular formula C17H15F2NO and a molecular weight of 287.31 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-2,3-difluorobenzamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-2,3-difluorobenzamide
PubChem CID62661017
Molecular FormulaC17H15F2NO
Molecular Weight287.31 g/mol
Exact Mass287.11
IUPAC NameN-benzyl-N-cyclopropyl-2,3-difluorobenzamide
SMILESO=C(c1cccc(F)c1F)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H15F2NO/c18-15-8-4-7-14(16(15)19)17(21)20(13-9-10-13)11-12-5-2-1-3-6-12/h1-8,13H,9-11H2
InChIKeyKZHQRGFSXDQVGW-UHFFFAOYSA-N
XLogP3.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.31
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-N-benzyl-N-cyclopropyl-3-fluorobenzamide
CID 81499537
N-cyclopropyl-N-ethyl-2,3-difluorobenzamide
CID 62649850
N-butyl-N-cyclopropyl-2,3-difluorobenzamide
CID 55210520
N-cyclopentyl-N-ethyl-2,3-difluorobenzamide
CID 55101771
3-[cyclopropyl-(2-fluorobenzoyl)amino]propanoic acid
CID 54926357
N-[(2-aminophenyl)methyl]-N-cyclopropyl-2-fluorobenzamide
CID 43460915
1-benzyl-1-cyclopropyl-3-ethylurea
CID 127578302
N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-hydroxybenzamide
CID 112817182
3-amino-N-benzyl-N-cyclopropylbenzamide
CID 43574369
N-benzyl-6-bromo-N-cyclopropylpyridine-2-carboxamide
CID 103874221
N-benzyl-N-cyclopropyl-5-methyl-1H-pyrazole-4-carboxamide
CID 63999824
N-benzyl-4-(bromomethyl)-N-cyclopropylbenzamide
CID 102850934

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-2,3-difluorobenzamide?
The IUPAC name of N-benzyl-N-cyclopropyl-2,3-difluorobenzamide (CID 62661017) is N-benzyl-N-cyclopropyl-2,3-difluorobenzamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-2,3-difluorobenzamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-2,3-difluorobenzamide is O=C(c1cccc(F)c1F)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-N-cyclopropyl-2,3-difluorobenzamide?
The InChIKey is KZHQRGFSXDQVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NO/c18-15-8-4-7-14(16(15)19)17(21)20(13-9-10-13)11-12-5-2-1-3-6-12/h1-8,13H,9-11H2.
What are the key properties of N-benzyl-N-cyclopropyl-2,3-difluorobenzamide?
N-benzyl-N-cyclopropyl-2,3-difluorobenzamide has a molecular weight of 287.31 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-2,3-difluorobenzamide is sourced from PubChem (CID 62661017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).