(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide

C17H25NO2 — CID 177440145

IUPAC(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide
SMILESCC(C)(C(=O)NC1CCCCC1)[C@H](O)c1ccccc1
InChIInChI=1S/C17H25NO2/c1-17(2,15(19)13-9-5-3-6-10-13)16(20)18-14-11-7-4-8-12-14/h3,5-6,9-10,14-15,19H,4,7-8,11-12H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyHCLHZQKMNBPFEM-OAHLLOKOSA-N
MW275.39 g/mol
LogP3.20
Rot. Bonds4

About (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide

(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide (PubChem CID 177440145) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide.

Molecular Properties

Compound Name(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide
PubChem CID177440145
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide
SMILESCC(C)(C(=O)NC1CCCCC1)[C@H](O)c1ccccc1
InChIInChI=1S/C17H25NO2/c1-17(2,15(19)13-9-5-3-6-10-13)16(20)18-14-11-7-4-8-12-14/h3,5-6,9-10,14-15,19H,4,7-8,11-12H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyHCLHZQKMNBPFEM-OAHLLOKOSA-N
XLogP3.20
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-cycloheptyl-2-phenylpropanamide;hydrochloride
CID 120586523
(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-chloro-N-cyclohexyl-2-phenylacetamide
CID 11032339
1-cycloheptyl-3-(2-phenylpropan-2-yl)urea
CID 110469316
(2R)-N-cyclohexyl-2-methoxy-2-phenylacetamide
CID 101462807
1-cyclohexyl-3-[(1R)-1-phenylethyl]urea
CID 840473
N-cycloheptyl-2-phenylbutanamide
CID 2890971
1-cyclohexyl-3-[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]urea
CID 40541623
1-cyclohexyl-3-[(1S,2S)-2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 70268253
1-cyclohexyl-3-[2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 15231966
N-cyclohexyl-2,2-difluoro-3-formamido-3-phenylpropanamide
CID 102287753
N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide
CID 108966069

Frequently Asked Questions

What is the IUPAC name of (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide?
The IUPAC name of (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide (CID 177440145) is (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide.
What is the SMILES notation for (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide?
The canonical SMILES for (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide is CC(C)(C(=O)NC1CCCCC1)[C@H](O)c1ccccc1.
What is the InChIKey of (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide?
The InChIKey is HCLHZQKMNBPFEM-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H25NO2/c1-17(2,15(19)13-9-5-3-6-10-13)16(20)18-14-11-7-4-8-12-14/h3,5-6,9-10,14-15,19H,4,7-8,11-12H2,1-2H3,(H,18,20)/t15-/m1/s1.
What are the key properties of (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide?
(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide has a molecular weight of 275.39 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide is sourced from PubChem (CID 177440145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).