(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide

C11H14Cl2N2O — CID 119302301

IUPAC(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide
SMILESC[C@@H](N)C(=O)NCCc1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O/c1-7(14)11(16)15-6-5-8-9(12)3-2-4-10(8)13/h2-4,7H,5-6,14H2,1H3,(H,15,16)/t7-/m1/s1
InChIKeyVTSDQUZUAFHBTB-SSDOTTSWSA-N
MW261.15 g/mol
LogP2.00
Rot. Bonds4

About (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide

(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide (PubChem CID 119302301) has the molecular formula C11H14Cl2N2O and a molecular weight of 261.15 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide
PubChem CID119302301
Molecular FormulaC11H14Cl2N2O
Molecular Weight261.15 g/mol
Exact Mass260.05
IUPAC Name(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide
SMILESC[C@@H](N)C(=O)NCCc1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O/c1-7(14)11(16)15-6-5-8-9(12)3-2-4-10(8)13/h2-4,7H,5-6,14H2,1H3,(H,15,16)/t7-/m1/s1
InChIKeyVTSDQUZUAFHBTB-SSDOTTSWSA-N
XLogP2.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.15
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-[(2,6-dichlorophenyl)methyl]propanamide
CID 66568204
(2S)-2-amino-N-[2-(2-chlorophenyl)ethyl]propanamide
CID 94684847
(2R)-2-amino-N-[2-(2,6-dichlorophenyl)propyl]propanamide;hydrochloride
CID 119315009
N-[2-(2-aminopropanoylamino)ethyl]-2-chlorobenzamide
CID 119278708
2-amino-N-[2-(2,6-dichlorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120789587
(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide
CID 78973575
(2R)-2-amino-N-[2-(2-hydroxyphenyl)ethyl]propanamide
CID 120872754
2-amino-N-[2-(2,4-dichlorophenyl)ethyl]propanamide;hydrochloride
CID 119263877
(2R)-2-amino-N-[2-(2,4-dichlorophenyl)ethyl]propanamide;hydrochloride
CID 119263879
4-amino-N-[2-(2,6-dichlorophenyl)ethyl]-3-methoxybutanamide
CID 120590079
(2R)-2-amino-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
CID 94686299
(2S)-2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]propanamide
CID 103630177

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide (CID 119302301) is (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide is C[C@@H](N)C(=O)NCCc1c(Cl)cccc1Cl.
What is the InChIKey of (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide?
The InChIKey is VTSDQUZUAFHBTB-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H14Cl2N2O/c1-7(14)11(16)15-6-5-8-9(12)3-2-4-10(8)13/h2-4,7H,5-6,14H2,1H3,(H,15,16)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide?
(2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide has a molecular weight of 261.15 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(2,6-dichlorophenyl)ethyl]propanamide is sourced from PubChem (CID 119302301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).