(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide

C14H19ClN2O2 — CID 8733082

IUPAC(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide
SMILESCCCNC(=O)[C@@H](C)NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C14H19ClN2O2/c1-3-8-16-14(19)10(2)17-13(18)9-11-4-6-12(15)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,16,19)(H,17,18)/t10-/m1/s1
InChIKeyGTVVLLKLVJTLMA-SNVBAGLBSA-N
MW282.77 g/mol
LogP1.91
Rot. Bonds6

About (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide

(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide (PubChem CID 8733082) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide.

Molecular Properties

Compound Name(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide
PubChem CID8733082
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide
SMILESCCCNC(=O)[C@@H](C)NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C14H19ClN2O2/c1-3-8-16-14(19)10(2)17-13(18)9-11-4-6-12(15)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,16,19)(H,17,18)/t10-/m1/s1
InChIKeyGTVVLLKLVJTLMA-SNVBAGLBSA-N
XLogP1.91
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(4-cyanophenyl)acetyl]amino]-N-propylpropanamide
CID 62404547
methyl 2-[[2-(4-chlorophenyl)acetyl]amino]propanoate
CID 60638078
(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 46388467
(2S)-2-[(2-chloroacetyl)amino]-N-propylpropanamide
CID 9207769
N-[2-[[2-(4-chlorophenyl)acetyl]amino]ethyl]propanamide
CID 108574115
(2R)-2-[3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]-N-propylpropanamide
CID 9227893
2-amino-4-chloro-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 61476340
[2-oxo-2-[[(2R)-1-oxo-1-(propylamino)propan-2-yl]amino]ethyl] 2-(3,4-dichlorophenyl)acetate
CID 9203223
2-(4-chlorophenyl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 8751569
2-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]propanamide
CID 60659584
2-[[2-(4-chlorophenyl)acetyl]-[(4-chlorophenyl)methyl]amino]-N-propylbutanamide
CID 132666533
2-(4-chlorophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]acetamide
CID 42561774

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide?
The IUPAC name of (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide (CID 8733082) is (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide.
What is the SMILES notation for (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide?
The canonical SMILES for (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide is CCCNC(=O)[C@@H](C)NC(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide?
The InChIKey is GTVVLLKLVJTLMA-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-3-8-16-14(19)10(2)17-13(18)9-11-4-6-12(15)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,16,19)(H,17,18)/t10-/m1/s1.
What are the key properties of (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide?
(2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide has a molecular weight of 282.77 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide is sourced from PubChem (CID 8733082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).