2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide

C19H21Cl2NO2 — CID 70457772

IUPAC2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide
SMILESCCCC(CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(N)=O
InChIInChI=1S/C19H21Cl2NO2/c1-2-3-13(18(22)23)12-19(24,14-4-8-16(20)9-5-14)15-6-10-17(21)11-7-15/h4-11,13,24H,2-3,12H2,1H3,(H2,22,23)
InChIKeyYQZPYNNJHFCYJZ-UHFFFAOYSA-N
MW366.29 g/mol
LogP4.52
Rot. Bonds7

About 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide

2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide (PubChem CID 70457772) has the molecular formula C19H21Cl2NO2 and a molecular weight of 366.29 g/mol. Its IUPAC name is 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide.

Molecular Properties

Compound Name2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide
PubChem CID70457772
Molecular FormulaC19H21Cl2NO2
Molecular Weight366.29 g/mol
Exact Mass365.09
IUPAC Name2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide
SMILESCCCC(CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(N)=O
InChIInChI=1S/C19H21Cl2NO2/c1-2-3-13(18(22)23)12-19(24,14-4-8-16(20)9-5-14)15-6-10-17(21)11-7-15/h4-11,13,24H,2-3,12H2,1H3,(H2,22,23)
InChIKeyYQZPYNNJHFCYJZ-UHFFFAOYSA-N
XLogP4.52
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.29
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-Chlorophenyl)-2-hydroxynonanamide
CID 10039502
(2S)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883321
(2R)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883322
2-(3-Chlorophenyl)-2-hydroxy-5,9-dimethyldec-8-enamide
CID 70693132
(4E)-2-(3-chlorophenyl)-2-hydroxy-5,9-dimethyldeca-4,8-dienamide
CID 70697237
4-(3,4-Dichlorophenyl)-4-hydroxyhexanamide
CID 10125386
3-Hydroxy-3-(3',4'-dichlorophenyl)pentanamide
CID 10149274
2-(2-Chloro-5-fluorophenyl)-3-(4-chlorophenyl)-2-hydroxypropanamide
CID 69950319
2-(4-Chloro-2-fluorophenyl)-2-hydroxy-2-phenylacetamide
CID 140016714
2-(4-Chloro-3-fluorophenyl)-2-hydroxy-2-phenylacetamide
CID 140163364
3-(4-Chlorophenyl)-2,2-difluoro-3-hydroxybutanamide
CID 163265569
3-(4-chlorophenyl)-3-hydroxy-N,N-dimethyl-4-phenylbutanamide
CID 92011668

Frequently Asked Questions

What is the IUPAC name of 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide?
The IUPAC name of 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide (CID 70457772) is 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide.
What is the SMILES notation for 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide?
The canonical SMILES for 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide is CCCC(CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(N)=O.
What is the InChIKey of 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide?
The InChIKey is YQZPYNNJHFCYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21Cl2NO2/c1-2-3-13(18(22)23)12-19(24,14-4-8-16(20)9-5-14)15-6-10-17(21)11-7-15/h4-11,13,24H,2-3,12H2,1H3,(H2,22,23).
What are the key properties of 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide?
2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide has a molecular weight of 366.29 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-bis(4-chlorophenyl)-2-hydroxyethyl]pentanamide is sourced from PubChem (CID 70457772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).