N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide

C14H18F2N2O — CID 102874077

IUPACN-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide
SMILESNCCN(C(=O)Cc1ccc(F)cc1F)C1CCC1
InChIInChI=1S/C14H18F2N2O/c15-11-5-4-10(13(16)9-11)8-14(19)18(7-6-17)12-2-1-3-12/h4-5,9,12H,1-3,6-8,17H2
InChIKeyLAYPDNXCJKBZCB-UHFFFAOYSA-N
MW268.31 g/mol
LogP1.85
Rot. Bonds5

About N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide

N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide (PubChem CID 102874077) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide
PubChem CID102874077
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC NameN-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide
SMILESNCCN(C(=O)Cc1ccc(F)cc1F)C1CCC1
InChIInChI=1S/C14H18F2N2O/c15-11-5-4-10(13(16)9-11)8-14(19)18(7-6-17)12-2-1-3-12/h4-5,9,12H,1-3,6-8,17H2
InChIKeyLAYPDNXCJKBZCB-UHFFFAOYSA-N
XLogP1.85
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cyclopropyl-[2-(2,4-difluorophenyl)acetyl]amino]-2-methylpropanoic acid
CID 120535316
N-(2-aminoethyl)-N-cyclopentyl-2-(2-hydroxyphenyl)acetamide
CID 80743733
N-(2-aminoethyl)-N-cyclobutyl-2,4,6-trifluorobenzamide
CID 102874150
N-(2-aminoethyl)-N-cyclohexyl-2-(2-hydroxyphenyl)acetamide
CID 80740387
N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide
CID 102874058
N-(2-chloroethyl)-N-cyclobutyl-2-(2-fluorophenyl)acetamide
CID 102872699
2-bromo-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]acetamide
CID 63679516
N-(3-aminopropyl)-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 43136754
N-(3-aminopropyl)-N-cyclopropyl-2-(2-fluorophenyl)acetamide
CID 43136756
N-(2-aminoethyl)-N-cyclopentyl-2-(3,4-dimethylphenyl)acetamide
CID 63754631
1-(aminomethyl)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]cyclobutane-1-carboxamide
CID 115448025
N-(2-aminoethyl)-N-cyclopentyl-2-(3-methylphenyl)acetamide
CID 63754808

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide (CID 102874077) is N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide is NCCN(C(=O)Cc1ccc(F)cc1F)C1CCC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide?
The InChIKey is LAYPDNXCJKBZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c15-11-5-4-10(13(16)9-11)8-14(19)18(7-6-17)12-2-1-3-12/h4-5,9,12H,1-3,6-8,17H2.
What are the key properties of N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide?
N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide has a molecular weight of 268.31 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 102874077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).