N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide

C18H16Cl2FNO — CID 134013693

IUPACN-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccccc1F)C1CC1
InChIInChI=1S/C18H16Cl2FNO/c19-15-8-5-12(9-16(15)20)10-18(23)22(14-6-7-14)11-13-3-1-2-4-17(13)21/h1-5,8-9,14H,6-7,10-11H2
InChIKeyKLJLVKANGAQCPI-UHFFFAOYSA-N
MW352.24 g/mol
LogP4.87
Rot. Bonds5

About N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide

N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide (PubChem CID 134013693) has the molecular formula C18H16Cl2FNO and a molecular weight of 352.24 g/mol. Its IUPAC name is N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide
PubChem CID134013693
Molecular FormulaC18H16Cl2FNO
Molecular Weight352.24 g/mol
Exact Mass351.06
IUPAC NameN-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccccc1F)C1CC1
InChIInChI=1S/C18H16Cl2FNO/c19-15-8-5-12(9-16(15)20)10-18(23)22(14-6-7-14)11-13-3-1-2-4-17(13)21/h1-5,8-9,14H,6-7,10-11H2
InChIKeyKLJLVKANGAQCPI-UHFFFAOYSA-N
XLogP4.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.24
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopropyl-1-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]methanesulfonamide
CID 56582102
2-amino-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide;hydrochloride
CID 119272337
2-(4-chloro-3-methylphenoxy)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide
CID 55391124
N-cyclopropyl-N-[(2-fluorophenyl)methyl]butanamide
CID 60666172
4-amino-N-cyclopropyl-N-[(2-fluorophenyl)methyl]butanamide
CID 54869271
N-cyclobutyl-2-(3,4-dichlorophenyl)-N-(2-hydroxyethyl)acetamide
CID 102684283
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]propanamide
CID 61061495
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 35367805
4-amino-N-cyclopropyl-N-[(2-fluorophenyl)methyl]butanamide;hydrochloride
CID 119272346
1-N,4-N-dicyclopropyl-1-N,4-N-bis[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 134013706
N-benzyl-2-(3-bromo-4-fluorophenyl)-N-cyclopropylacetamide
CID 60526454
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-phenylsulfanylacetamide
CID 78810506

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide?
The IUPAC name of N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide (CID 134013693) is N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide is O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccccc1F)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide?
The InChIKey is KLJLVKANGAQCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2FNO/c19-15-8-5-12(9-16(15)20)10-18(23)22(14-6-7-14)11-13-3-1-2-4-17(13)21/h1-5,8-9,14H,6-7,10-11H2.
What are the key properties of N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide?
N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide has a molecular weight of 352.24 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3,4-dichlorophenyl)-N-[(2-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 134013693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).