N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide

C16H17ClN2O2 — CID 65124387

IUPACN-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide
SMILESCc1c(N)cccc1NC(=O)COCc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c1-11-14(18)3-2-4-15(11)19-16(20)10-21-9-12-5-7-13(17)8-6-12/h2-8H,9-10,18H2,1H3,(H,19,20)
InChIKeyYVVXPVJNMUQDHF-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.39
Rot. Bonds5

About N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide

N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide (PubChem CID 65124387) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide
PubChem CID65124387
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide
SMILESCc1c(N)cccc1NC(=O)COCc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c1-11-14(18)3-2-4-15(11)19-16(20)10-21-9-12-5-7-13(17)8-6-12/h2-8H,9-10,18H2,1H3,(H,19,20)
InChIKeyYVVXPVJNMUQDHF-UHFFFAOYSA-N
XLogP3.39
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)-3-[(4-chlorophenyl)methoxy]propanamide
CID 65124536
N-(3-amino-4-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide
CID 65124877
N-(3-amino-2-methylphenyl)-4-phenylmethoxybutanamide
CID 16784272
N-(4-chlorophenyl)-2-[(2-phenylmethoxyacetyl)amino]benzamide
CID 55466370
N-(2-aminophenyl)-2-(4-chlorophenoxy)acetamide
CID 16786707
CID 153403326
CID 153403326
N-(3-amino-2-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 16781912
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 3-[4-[(4-chlorophenyl)methoxy]phenyl]prop-2-enoate
CID 4613514
3-N-[2-(4-chlorophenyl)ethyl]-2-methylbenzene-1,3-diamine
CID 63078168
3-[[2-(4-chlorophenyl)acetyl]amino]-2-methylbenzoic acid
CID 974933
N-(3-amino-2-methylphenyl)-4-propoxybutanamide
CID 43247848
N-(5-amino-2-fluorophenyl)-2-phenylmethoxyacetamide
CID 16785782

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide?
The IUPAC name of N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide (CID 65124387) is N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide.
What is the SMILES notation for N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide?
The canonical SMILES for N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide is Cc1c(N)cccc1NC(=O)COCc1ccc(Cl)cc1.
What is the InChIKey of N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide?
The InChIKey is YVVXPVJNMUQDHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-11-14(18)3-2-4-15(11)19-16(20)10-21-9-12-5-7-13(17)8-6-12/h2-8H,9-10,18H2,1H3,(H,19,20).
What are the key properties of N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide?
N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylphenyl)-2-[(4-chlorophenyl)methoxy]acetamide is sourced from PubChem (CID 65124387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).