2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide

C15H14BrClN2O2 — CID 17098530

IUPAC2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide
SMILESCC(C)(Oc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C15H14BrClN2O2/c1-15(2,21-12-6-3-10(16)4-7-12)14(20)19-13-8-5-11(17)9-18-13/h3-9H,1-2H3,(H,18,19,20)
InChIKeySMNVPKGANKWNBG-UHFFFAOYSA-N
MW369.65 g/mol
LogP4.29
Rot. Bonds4

About 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide

2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide (PubChem CID 17098530) has the molecular formula C15H14BrClN2O2 and a molecular weight of 369.65 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide
PubChem CID17098530
Molecular FormulaC15H14BrClN2O2
Molecular Weight369.65 g/mol
Exact Mass367.99
IUPAC Name2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide
SMILESCC(C)(Oc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C15H14BrClN2O2/c1-15(2,21-12-6-3-10(16)4-7-12)14(20)19-13-8-5-11(17)9-18-13/h3-9H,1-2H3,(H,18,19,20)
InChIKeySMNVPKGANKWNBG-UHFFFAOYSA-N
XLogP4.29
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.65
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl] 2-(4-chlorophenoxy)-2-methylpropanoate
CID 7762797
2-(4-chlorophenoxy)-2-methyl-N-(1-methylpyrazol-3-yl)propanamide
CID 7638240
2-(4-chlorophenoxy)-2-methyl-N-(6-methyl-2-pyridinyl)propanamide
CID 800401
N-(4-bromo-2-fluorophenyl)-2-(4-bromophenoxy)-2-methylpropanamide
CID 17099076
methyl 4-[(5-bromo-2-pyridinyl)amino]-3,3-dimethyl-4-oxobutanoate
CID 90009998
2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide
CID 51279285
N-[(4-bromophenyl)methylideneamino]-2-(4-chlorophenoxy)-2-methylpropanamide
CID 5261629
N-(4-bromophenyl)-2-methyl-2-phenoxypropanamide
CID 11858792
N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 949027
N-(4-amino-2-chloro-6-methylphenyl)-2-(4-bromophenoxy)-2-methylpropanamide
CID 100828380
2-(4-bromophenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methylpropanamide
CID 30309483
2-(4-chlorophenoxy)-N-(3,5-dimethoxyphenyl)-2-methylpropanamide
CID 848261

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide?
The IUPAC name of 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide (CID 17098530) is 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide is CC(C)(Oc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide?
The InChIKey is SMNVPKGANKWNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O2/c1-15(2,21-12-6-3-10(16)4-7-12)14(20)19-13-8-5-11(17)9-18-13/h3-9H,1-2H3,(H,18,19,20).
What are the key properties of 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide?
2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide has a molecular weight of 369.65 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-(5-chloro-2-pyridinyl)-2-methylpropanamide is sourced from PubChem (CID 17098530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).