N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide

C12H15IN2O — CID 65477363

IUPACN-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide
SMILESO=C(CNCc1ccc(I)cc1)NC1CC1
InChIInChI=1S/C12H15IN2O/c13-10-3-1-9(2-4-10)7-14-8-12(16)15-11-5-6-11/h1-4,11,14H,5-8H2,(H,15,16)
InChIKeyMZEQFMBZLCEDDB-UHFFFAOYSA-N
MW330.17 g/mol
LogP1.66
Rot. Bonds5

About N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide

N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide (PubChem CID 65477363) has the molecular formula C12H15IN2O and a molecular weight of 330.17 g/mol. Its IUPAC name is N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide
PubChem CID65477363
Molecular FormulaC12H15IN2O
Molecular Weight330.17 g/mol
Exact Mass330.02
IUPAC NameN-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide
SMILESO=C(CNCc1ccc(I)cc1)NC1CC1
InChIInChI=1S/C12H15IN2O/c13-10-3-1-9(2-4-10)7-14-8-12(16)15-11-5-6-11/h1-4,11,14H,5-8H2,(H,15,16)
InChIKeyMZEQFMBZLCEDDB-UHFFFAOYSA-N
XLogP1.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.17
LogP ≤ 51.66
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

N-cyclopropyl-2-[(4-methylsulfanylphenyl)methylamino]acetamide
CID 43401901
N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide
CID 43434265
2-(benzylamino)-N-cyclohexylacetamide
CID 19163991
2-[(4-bromophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63099192
2-[(4-chlorophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63099718
2-[(4-bromo-3-chlorophenyl)methylamino]-N-cyclopropylacetamide
CID 103581537
N-cyclopropyl-2-[(4-hydroxy-3-methoxyphenyl)methylamino]acetamide
CID 43329464
3-[[[2-(cyclopropylamino)-2-oxoethyl]amino]methyl]benzoic acid
CID 103239145
4-[(4-iodophenyl)methylamino]cyclohexane-1-carboxylic acid
CID 65478258
N-cyclopent-3-en-1-yl-2-(4-iodophenyl)acetamide
CID 100619155
N-cyclopropyl-2-[(2,3,6-trichlorophenyl)methylamino]acetamide
CID 43434263
N-cyclopropyl-3-[(4-methylphenyl)methylamino]propanamide
CID 55090993

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide (CID 65477363) is N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide is O=C(CNCc1ccc(I)cc1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide?
The InChIKey is MZEQFMBZLCEDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15IN2O/c13-10-3-1-9(2-4-10)7-14-8-12(16)15-11-5-6-11/h1-4,11,14H,5-8H2,(H,15,16).
What are the key properties of N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide?
N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide has a molecular weight of 330.17 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide is sourced from PubChem (CID 65477363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).