(2S)-2-anilino-N-(3-chlorophenyl)propanamide

C15H15ClN2O — CID 7928382

IUPAC(2S)-2-anilino-N-(3-chlorophenyl)propanamide
SMILESC[C@H](Nc1ccccc1)C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-11(17-13-7-3-2-4-8-13)15(19)18-14-9-5-6-12(16)10-14/h2-11,17H,1H3,(H,18,19)/t11-/m0/s1
InChIKeyHLDAGKOYPQITMW-NSHDSACASA-N
MW274.75 g/mol
LogP3.78
Rot. Bonds4

About (2S)-2-anilino-N-(3-chlorophenyl)propanamide

(2S)-2-anilino-N-(3-chlorophenyl)propanamide (PubChem CID 7928382) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is (2S)-2-anilino-N-(3-chlorophenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-anilino-N-(3-chlorophenyl)propanamide
PubChem CID7928382
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name(2S)-2-anilino-N-(3-chlorophenyl)propanamide
SMILESC[C@H](Nc1ccccc1)C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-11(17-13-7-3-2-4-8-13)15(19)18-14-9-5-6-12(16)10-14/h2-11,17H,1H3,(H,18,19)/t11-/m0/s1
InChIKeyHLDAGKOYPQITMW-NSHDSACASA-N
XLogP3.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(3-chlorophenyl)-2-[4-(methanesulfonamido)anilino]propanamide
CID 31267963
3-[[1-(3-chloroanilino)-1-oxopropan-2-yl]amino]-N-methylbenzamide
CID 51167571
(2R)-2-(benzylamino)-N-(3-chlorophenyl)propanamide
CID 2608999
(2S)-2-chloro-N-(3-chlorophenyl)propanamide
CID 2404784
(2R)-N-(3-chlorophenyl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
CID 97347601
(2S)-N-(3-chlorophenyl)-2-[4-(tetrazol-1-yl)anilino]propanamide
CID 51969626
(2S)-N-(3-chlorophenyl)-2-methyl-3-phenylpropanamide
CID 56610654
2-(2,5-dichloroanilino)-N-phenylpropanamide
CID 43083844
(2S,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385868
N-(3-chlorophenyl)-2-methylbutanamide
CID 4636150
(2R,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385866
N-(3-chlorophenyl)-2-[4-(2-methyl-1,3-thiazol-4-yl)anilino]propanamide
CID 24561871

Frequently Asked Questions

What is the IUPAC name of (2S)-2-anilino-N-(3-chlorophenyl)propanamide?
The IUPAC name of (2S)-2-anilino-N-(3-chlorophenyl)propanamide (CID 7928382) is (2S)-2-anilino-N-(3-chlorophenyl)propanamide.
What is the SMILES notation for (2S)-2-anilino-N-(3-chlorophenyl)propanamide?
The canonical SMILES for (2S)-2-anilino-N-(3-chlorophenyl)propanamide is C[C@H](Nc1ccccc1)C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of (2S)-2-anilino-N-(3-chlorophenyl)propanamide?
The InChIKey is HLDAGKOYPQITMW-NSHDSACASA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-11(17-13-7-3-2-4-8-13)15(19)18-14-9-5-6-12(16)10-14/h2-11,17H,1H3,(H,18,19)/t11-/m0/s1.
What are the key properties of (2S)-2-anilino-N-(3-chlorophenyl)propanamide?
(2S)-2-anilino-N-(3-chlorophenyl)propanamide has a molecular weight of 274.75 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-anilino-N-(3-chlorophenyl)propanamide is sourced from PubChem (CID 7928382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).