(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide

C14H12ClIN2O — CID 61180487

IUPAC(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide
SMILESN[C@@H](C(=O)Nc1ccc(I)cc1Cl)c1ccccc1
InChIInChI=1S/C14H12ClIN2O/c15-11-8-10(16)6-7-12(11)18-14(19)13(17)9-4-2-1-3-5-9/h1-8,13H,17H2,(H,18,19)/t13-/m1/s1
InChIKeyFWVKHFORKQRDRQ-CYBMUJFWSA-N
MW386.62 g/mol
LogP3.58
Rot. Bonds3

About (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide

(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide (PubChem CID 61180487) has the molecular formula C14H12ClIN2O and a molecular weight of 386.62 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide
PubChem CID61180487
Molecular FormulaC14H12ClIN2O
Molecular Weight386.62 g/mol
Exact Mass385.97
IUPAC Name(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide
SMILESN[C@@H](C(=O)Nc1ccc(I)cc1Cl)c1ccccc1
InChIInChI=1S/C14H12ClIN2O/c15-11-8-10(16)6-7-12(11)18-14(19)13(17)9-4-2-1-3-5-9/h1-8,13H,17H2,(H,18,19)/t13-/m1/s1
InChIKeyFWVKHFORKQRDRQ-CYBMUJFWSA-N
XLogP3.58
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.62
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-[[(2S)-2-amino-2-phenylacetyl]amino]-3-chlorobenzoic acid
CID 103869601
2-amino-N-(2-chloro-4-fluorophenyl)-2-phenylacetamide
CID 43150560
3-amino-N-(2-chloro-4-iodophenyl)-2-phenyl-3-sulfanylidenepropanamide
CID 107605681
N-(2-chloro-4-iodophenyl)-2-phenyl-2-pyrrolidin-1-ylacetamide
CID 56556713
1-amino-3-(2-chloro-4-iodophenyl)urea
CID 107605938
2-bromo-N-(2-chloro-4-iodophenyl)propanamide
CID 107903978
2-amino-N-(3-chloro-2-fluorophenyl)-2-phenylacetamide
CID 43123024
N-(2-chloro-4-iodophenyl)-2-phenylacetamide
CID 1371739
N-(2-chloro-4-iodophenyl)acetamide
CID 18434368
2-amino-N-(2-chloro-4-iodophenyl)-4-methylsulfonylbutanamide
CID 43713313
(2S)-2-amino-N-(4-chloro-2-nitrophenyl)-2-phenylacetamide
CID 104897258
1-(2-chloro-4-iodophenyl)-3-propan-2-ylurea
CID 47202224

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide (CID 61180487) is (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide is N[C@@H](C(=O)Nc1ccc(I)cc1Cl)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide?
The InChIKey is FWVKHFORKQRDRQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H12ClIN2O/c15-11-8-10(16)6-7-12(11)18-14(19)13(17)9-4-2-1-3-5-9/h1-8,13H,17H2,(H,18,19)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide?
(2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide has a molecular weight of 386.62 g/mol, XLogP of 3.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-chloro-4-iodophenyl)-2-phenylacetamide is sourced from PubChem (CID 61180487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).