N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide

C12H14Cl2N2O — CID 113282152

IUPACN-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide
SMILESNC(CNC(=O)c1c(Cl)cccc1Cl)C1CC1
InChIInChI=1S/C12H14Cl2N2O/c13-8-2-1-3-9(14)11(8)12(17)16-6-10(15)7-4-5-7/h1-3,7,10H,4-6,15H2,(H,16,17)
InChIKeyURPWCKUXKJBPBL-UHFFFAOYSA-N
MW273.16 g/mol
LogP2.46
Rot. Bonds4

About N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide

N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide (PubChem CID 113282152) has the molecular formula C12H14Cl2N2O and a molecular weight of 273.16 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide
PubChem CID113282152
Molecular FormulaC12H14Cl2N2O
Molecular Weight273.16 g/mol
Exact Mass272.05
IUPAC NameN-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide
SMILESNC(CNC(=O)c1c(Cl)cccc1Cl)C1CC1
InChIInChI=1S/C12H14Cl2N2O/c13-8-2-1-3-9(14)11(8)12(17)16-6-10(15)7-4-5-7/h1-3,7,10H,4-6,15H2,(H,16,17)
InChIKeyURPWCKUXKJBPBL-UHFFFAOYSA-N
XLogP2.46
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.16
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-cyclopropylethyl)-2-chloro-6-fluorobenzamide
CID 115301115
N-(2-amino-2-cyclopropylethyl)thiophene-2-carboxamide
CID 115301080
N-(2-amino-2-cyclopropylethyl)-5-bromo-2-chlorobenzamide
CID 113282173
N-(2-amino-2-cyclopropylethyl)-2,4,6-trifluorobenzamide
CID 65100401
N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide
CID 106688585
N-(2-amino-2-cyclopropylethyl)-3-methylbenzamide
CID 63765168
N-(2-amino-2-cyclopropylethyl)-2-(trifluoromethyl)benzamide
CID 63765171
N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide
CID 103872680
N-(2-amino-2-cyclopropylethyl)-2-chloro-5-nitrobenzamide
CID 115301113
N-(4-bromo-2-methylbutyl)-2,6-dichlorobenzamide
CID 114316754
2-cyclopropyl-2-[(2,6-dichlorobenzoyl)amino]acetic acid
CID 62694940
N-(2-amino-2-cyclopropylethyl)-3-methylsulfonylbenzamide
CID 55243718

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide (CID 113282152) is N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide is NC(CNC(=O)c1c(Cl)cccc1Cl)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide?
The InChIKey is URPWCKUXKJBPBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O/c13-8-2-1-3-9(14)11(8)12(17)16-6-10(15)7-4-5-7/h1-3,7,10H,4-6,15H2,(H,16,17).
What are the key properties of N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide?
N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide has a molecular weight of 273.16 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide is sourced from PubChem (CID 113282152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).