(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide

C13H16Cl2N2O — CID 9274926

IUPAC(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide
SMILESC[C@H](C(=O)Nc1c(Cl)cccc1Cl)N1CCCC1
InChIInChI=1S/C13H16Cl2N2O/c1-9(17-7-2-3-8-17)13(18)16-12-10(14)5-4-6-11(12)15/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)/t9-/m1/s1
InChIKeyGGERYUVSWLWAFY-SECBINFHSA-N
MW287.19 g/mol
LogP3.42
Rot. Bonds3

About (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide

(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide (PubChem CID 9274926) has the molecular formula C13H16Cl2N2O and a molecular weight of 287.19 g/mol. Its IUPAC name is (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide
PubChem CID9274926
Molecular FormulaC13H16Cl2N2O
Molecular Weight287.19 g/mol
Exact Mass286.06
IUPAC Name(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide
SMILESC[C@H](C(=O)Nc1c(Cl)cccc1Cl)N1CCCC1
InChIInChI=1S/C13H16Cl2N2O/c1-9(17-7-2-3-8-17)13(18)16-12-10(14)5-4-6-11(12)15/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)/t9-/m1/s1
InChIKeyGGERYUVSWLWAFY-SECBINFHSA-N
XLogP3.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.19
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-amino-2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide
CID 43080000
(2R)-N-(2,6-dichlorophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 9445447
(2R)-N-(2,6-dichlorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 9446073
(2S)-N-(2,6-dichlorophenyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]propanamide
CID 31482613
(2S)-N-(2,6-dichlorophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430308
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpropanamide
CID 51167813
N-phenyl-2-piperidin-1-ylpropanamide
CID 4788909
2-bromo-N-(2,6-dichlorophenyl)propanamide
CID 53414281
N-(4-amino-2-chlorophenyl)-2-piperidin-1-ylpropanamide
CID 16786642
(2S)-2-(azepan-1-yl)-N-(2-chloro-3-pyridinyl)propanamide
CID 9249896
2-(azepan-1-yl)-N-(3-chloro-4-fluorophenyl)propanamide
CID 46630970
(2R)-2-(azocan-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 9460394

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide?
The IUPAC name of (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide (CID 9274926) is (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide?
The canonical SMILES for (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide is C[C@H](C(=O)Nc1c(Cl)cccc1Cl)N1CCCC1.
What is the InChIKey of (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide?
The InChIKey is GGERYUVSWLWAFY-SECBINFHSA-N. The full InChI is InChI=1S/C13H16Cl2N2O/c1-9(17-7-2-3-8-17)13(18)16-12-10(14)5-4-6-11(12)15/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)/t9-/m1/s1.
What are the key properties of (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide?
(2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide has a molecular weight of 287.19 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 9274926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).