2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide

C16H19N3O2 — CID 64823770

IUPAC2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C16H19N3O2/c17-14-7-2-1-6-13(14)16(20)19-12-5-3-4-11(8-12)15-9-18-10-21-15/h3-5,8-10,13-14H,1-2,6-7,17H2,(H,19,20)
InChIKeyPPPUMBDWYXYWKA-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.80
Rot. Bonds3

About 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide

2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide (PubChem CID 64823770) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide
PubChem CID64823770
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C16H19N3O2/c17-14-7-2-1-6-13(14)16(20)19-12-5-3-4-11(8-12)15-9-18-10-21-15/h3-5,8-10,13-14H,1-2,6-7,17H2,(H,19,20)
InChIKeyPPPUMBDWYXYWKA-UHFFFAOYSA-N
XLogP2.80
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

9-amino-N-[3-(1,3-oxazol-5-yl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120986715
(2R)-1-(cyclohexanecarbonyl)-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrolidine-2-carboxamide
CID 95350172
1-cyclohexyl-1-methyl-3-[3-(1,3-oxazol-5-yl)phenyl]urea
CID 72886720
2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopropane-1-carboxamide
CID 114997982
trans-(1R,2R)-2-amino-N-phenylcyclohexane-1-carboxamide
CID 10889384
2-amino-N-[3-(carbamoylamino)phenyl]cyclopentane-1-carboxamide
CID 64822966
2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
2-amino-N-pyridin-3-ylcyclopentane-1-carboxamide
CID 64817349
5-[3-(1,3-oxazol-5-yl)anilino]-5-oxopentanoic acid
CID 60934205
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2-amino-N-[3-(dimethylamino)phenyl]cycloheptane-1-carboxamide
CID 115377162

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide (CID 64823770) is 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide is NC1CCCCC1C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide?
The InChIKey is PPPUMBDWYXYWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c17-14-7-2-1-6-13(14)16(20)19-12-5-3-4-11(8-12)15-9-18-10-21-15/h3-5,8-10,13-14H,1-2,6-7,17H2,(H,19,20).
What are the key properties of 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide?
2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 64823770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).