(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide

C19H18ClN3O2 — CID 92685089

IUPAC(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccccc1-n1ccnc1
InChIInChI=1S/C19H18ClN3O2/c1-14(25-18-9-5-3-7-16(18)20)19(24)22-12-15-6-2-4-8-17(15)23-11-10-21-13-23/h2-11,13-14H,12H2,1H3,(H,22,24)/t14-/m1/s1
InChIKeyYJXQYJPZFAMSTL-CQSZACIVSA-N
MW355.83 g/mol
LogP3.61
Rot. Bonds6

About (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide

(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide (PubChem CID 92685089) has the molecular formula C19H18ClN3O2 and a molecular weight of 355.83 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide
PubChem CID92685089
Molecular FormulaC19H18ClN3O2
Molecular Weight355.83 g/mol
Exact Mass355.11
IUPAC Name(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccccc1-n1ccnc1
InChIInChI=1S/C19H18ClN3O2/c1-14(25-18-9-5-3-7-16(18)20)19(24)22-12-15-6-2-4-8-17(15)23-11-10-21-13-23/h2-11,13-14H,12H2,1H3,(H,22,24)/t14-/m1/s1
InChIKeyYJXQYJPZFAMSTL-CQSZACIVSA-N
XLogP3.61
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.83
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(3-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide
CID 99957835
(2S)-N-[(2-imidazol-1-ylphenyl)methyl]-2-(2-methylphenoxy)butanamide
CID 28574318
(2R)-2-(4-fluorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]butanamide
CID 92686153
2-(2,6-dimethoxyphenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 136514293
2-[(2-chlorophenyl)methylsulfanyl]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 30388148
2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 92680055
4-(2,4-dichlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]butanamide
CID 52740396
2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 132656973
2-(2-chlorophenoxy)-N-(2-pyridin-3-ylethyl)propanamide
CID 46447544
(2S)-2-(2-chlorophenoxy)-N-[(4-fluorophenyl)methyl]propanamide
CID 26529894
1-(1-hydroxy-4-methylpentan-3-yl)-3-[(2-imidazol-1-ylphenyl)methyl]urea
CID 111505245
2-(2-chlorophenoxy)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83030471

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide?
The IUPAC name of (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide (CID 92685089) is (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide.
What is the SMILES notation for (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide?
The canonical SMILES for (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide is C[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccccc1-n1ccnc1.
What is the InChIKey of (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide?
The InChIKey is YJXQYJPZFAMSTL-CQSZACIVSA-N. The full InChI is InChI=1S/C19H18ClN3O2/c1-14(25-18-9-5-3-7-16(18)20)19(24)22-12-15-6-2-4-8-17(15)23-11-10-21-13-23/h2-11,13-14H,12H2,1H3,(H,22,24)/t14-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide?
(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide has a molecular weight of 355.83 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide is sourced from PubChem (CID 92685089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).