(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide

C15H19N3O2 — CID 103831428

IUPAC(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C15H19N3O2/c1-2-3-4-13(16)15(19)18-12-7-5-11(6-8-12)14-9-17-10-20-14/h5-10,13H,2-4,16H2,1H3,(H,18,19)/t13-/m0/s1
InChIKeyZXJOMXQWPGEYRD-ZDUSSCGKSA-N
MW273.34 g/mol
LogP2.80
Rot. Bonds6

About (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide

(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide (PubChem CID 103831428) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide
PubChem CID103831428
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C15H19N3O2/c1-2-3-4-13(16)15(19)18-12-7-5-11(6-8-12)14-9-17-10-20-14/h5-10,13H,2-4,16H2,1H3,(H,18,19)/t13-/m0/s1
InChIKeyZXJOMXQWPGEYRD-ZDUSSCGKSA-N
XLogP2.80
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60926904
2-amino-3-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide;hydrochloride
CID 119724910
3-(ethylamino)-2-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 62853092
2-amino-N-(4-bromophenyl)hexanamide
CID 60852203
methyl N-[4-[[(2S)-2-aminohexanoyl]amino]phenyl]carbamate
CID 103831481
2-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]pentanamide
CID 119279222
3-ethylsulfanyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 87046910
(2S)-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenyl-2-(propan-2-ylamino)propanamide
CID 126517027
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 61180352
2-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 60812605
ethyl 4-[[(2S)-2-aminohexanoyl]amino]benzoate
CID 103830868

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide?
The IUPAC name of (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide (CID 103831428) is (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide.
What is the SMILES notation for (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide?
The canonical SMILES for (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide is CCCC[C@H](N)C(=O)Nc1ccc(-c2cnco2)cc1.
What is the InChIKey of (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide?
The InChIKey is ZXJOMXQWPGEYRD-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-3-4-13(16)15(19)18-12-7-5-11(6-8-12)14-9-17-10-20-14/h5-10,13H,2-4,16H2,1H3,(H,18,19)/t13-/m0/s1.
What are the key properties of (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide?
(2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide has a molecular weight of 273.34 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide is sourced from PubChem (CID 103831428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).